heptyl 4-[[4-[4-[(4-heptoxycarbonylphenyl)carbamoyl]phenoxy]phenyl]carbonylamino]benzoate

Systemtic Name: heptyl 4-[[4-[4-[(4-heptoxycarbonylphenyl)carbamoyl]phenoxy]phenyl]carbonylamino]benzoate Openeye Name: heptyl 4-[[4-[4-[(4-heptoxycarbonylphenyl)carbamoyl]phenoxy]benzoyl]amino]benzoate CAS Name: 4-[[[4-[4-[[4-[heptoxy(oxo)methyl]anilino]-oxomethyl]phenoxy]phenyl]-oxomethyl]amino]benzoic acid heptyl ester IUPAC Name: heptyl 4-[[4-[4-[(4-heptoxycarbonylphenyl)carbamoyl]phenoxy]benzoyl]amino]benzoate Traditional Name: 4-[[4-[4-[(4-heptoxycarbonylphenyl)carbamoyl]phenoxy]benzoyl]amino]benzoic acid heptyl ester Formula: C42H48N2O7 MolecularWeight: 692.83972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)OCCCCCCC

Isomeric SMILES

CCCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)OCCCCCCC

InChI

InChI=1S/C42H48N2O7/c1-3-5-7-9-11-29-49-41(47)33-13-21-35(22-14-33)43-39(45)31-17-25-37(26-18-31)51-38-27-19-32(20-28-38)40(46)44-36-23-15-34(16-24-36)42(48)50-30-12-10-8-6-4-2/h13-28H,3-12,29-30H2,1-2H3,(H,43,45)(H,44,46)