trisodium; 3-[[9-[[2,3-bis(oxidanidyl)phenyl]carbonylamino]-5-[3-[[2,3-bis(oxidanidyl)phenyl]carbonylamino]propyl]-5-[[3,4,5-tris[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methylcarbamoyl]nonyl]carbamoyl]benzene-1,2-diolate; technetium-99

Systemtic Name: trisodium; 3-[[9-[[2,3-bis(oxidanidyl)phenyl]carbonylamino]-5-[3-[[2,3-bis(oxidanidyl)phenyl]carbonylamino]propyl]-5-[[3,4,5-tris[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methylcarbamoyl]nonyl]carbamoyl]benzene-1,2-diolate; technetium-99 Openeye Name: trisodium; 3-[[9-[(2,3-dioxidobenzoyl)amino]-5-[3-[(2,3-dioxidobenzoyl)amino]propyl]-5-[[3,4,5-tris[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methylcarbamoyl]nonyl]carbamoyl]benzene-1,2-diolate; technetium-99 CAS Name: trisodium; 3-[[[9-[[(2,3-dioxidophenyl)-oxomethyl]amino]-5-[3-[[(2,3-dioxidophenyl)-oxomethyl]amino]propyl]-5-[oxo-[[3,4,5-tris[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methylamino]methyl]nonyl]amino]-oxomethyl]benzene-1,2-diolate; technetium-99 IUPAC Name: trisodium; 3-[[9-[(2,3-dioxidobenzoyl)amino]-5-[3-[(2,3-dioxidobenzoyl)amino]propyl]-5-[[3,4,5-tris[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methylcarbamoyl]nonyl]carbamoyl]benzene-1,2-diolate; technetium-99 Traditional Name: trisodium; 3-[[9-[(2,3-dioxidobenzoyl)amino]-5-[3-[(2,3-dioxidobenzoyl)amino]propyl]-5-[[3,4,5-tris[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]benzyl]carbamoyl]nonyl]carbamoyl]benzene-1,2-diolate; technetium-99 Formula: C62H84N4Na3O22Tc-3 MolecularWeight: 1405.219525

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCCOCCOC1=CC(=CC(=C1OCCOCCOCCOC)OCCOCCOCCOC)CNC(=O)C(CCCCNC(=O)C2=C(C(=CC=C2)[O-])[O-])(CCCCNC(=O)C3=C(C(=CC=C3)[O-])[O-])CCCNC(=O)C4=C(C(=CC=C4)[O-])[O-].[Na+].[Na+].[Na+].[Tc]

Isomeric SMILES

COCCOCCOCCOC1=CC(=CC(=C1OCCOCCOCCOC)OCCOCCOCCOC)CNC(=O)C(CCCCNC(=O)C2=C(C(=CC=C2)[O-])[O-])(CCCCNC(=O)C3=C(C(=CC=C3)[O-])[O-])CCCNC(=O)C4=C(C(=CC=C4)[O-])[O-].[Na+].[Na+].[Na+].[99Tc]

InChI

InChI=1S/C62H90N4O22.3Na.Tc/c1-77-24-27-80-30-33-83-36-39-86-52-42-45(43-53(87-40-37-84-34-31-81-28-25-78-2)57(52)88-41-38-85-35-32-82-29-26-79-3)44-66-61(76)62(20-11-23-65-60(75)48-14-10-17-51(69)56(48)72,18-4-6-21-63-58(73)46-12-8-15-49(67)54(46)70)19-5-7-22-64-59(74)47-13-9-16-50(68)55(47)71;;;;/h8-10,12-17,42-43,67-72H,4-7,11,18-41,44H2,1-3H3,(H,63,73)(H,64,74)(H,65,75)(H,66,76);;;;/q;3*+1;/p-6/i;;;;1+1