hexadecyl 3,5-bis[(4-aminophenyl)carbonylamino]benzoate

Systemtic Name: hexadecyl 3,5-bis[(4-aminophenyl)carbonylamino]benzoate Openeye Name: hexadecyl 3,5-bis[(4-aminobenzoyl)amino]benzoate CAS Name: 3,5-bis[[(4-aminophenyl)-oxomethyl]amino]benzoic acid hexadecyl ester IUPAC Name: hexadecyl 3,5-bis[(4-aminobenzoyl)amino]benzoate Traditional Name: 3,5-bis[(4-aminobenzoyl)amino]benzoic acid cetyl ester Formula: C37H50N4O4 MolecularWeight: 614.8173

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N)NC(=O)C3=CC=C(C=C3)N

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N)NC(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C37H50N4O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24-45-37(44)30-25-33(40-35(42)28-16-20-31(38)21-17-28)27-34(26-30)41-36(43)29-18-22-32(39)23-19-29/h16-23,25-27H,2-15,24,38-39H2,1H3,(H,40,42)(H,41,43)