2-[carboxymethyl-[2-[(4-hexoxyphenyl)amino]-2-oxidanylidene-ethyl]amino]ethanoic acid; technetium-99

Systemtic Name: 2-[carboxymethyl-[2-[(4-hexoxyphenyl)amino]-2-oxidanylidene-ethyl]amino]ethanoic acid; technetium-99 Openeye Name: 2-[carboxymethyl-[2-(4-hexoxyanilino)-2-oxo-ethyl]amino]acetic acid; technetium-99 CAS Name: 2-[carboxymethyl-[2-(4-hexoxyanilino)-2-oxoethyl]amino]acetic acid; technetium-99 IUPAC Name: 2-[carboxymethyl-[2-(4-hexoxyanilino)-2-oxoethyl]amino]acetic acid; technetium-99 Traditional Name: 2-[carboxymethyl-[2-(4-hexoxyanilino)-2-keto-ethyl]amino]acetic acid; technetium-99 Formula: C18H26N2O6Tc MolecularWeight: 465.315095

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC(=O)CN(CC(=O)O)CC(=O)O.[Tc]

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC(=O)CN(CC(=O)O)CC(=O)O.[99Tc]

InChI

InChI=1S/C18H26N2O6.Tc/c1-2-3-4-5-10-26-15-8-6-14(7-9-15)19-16(21)11-20(12-17(22)23)13-18(24)25;/h6-9H,2-5,10-13H2,1H3,(H,19,21)(H,22,23)(H,24,25);/i;1+1