4-[[[10-[(4-carboxyphenyl)methylamino]-10-oxidanylidene-decanoyl]amino]methyl]benzoic acid

Systemtic Name: 4-[[[10-[(4-carboxyphenyl)methylamino]-10-oxidanylidene-decanoyl]amino]methyl]benzoic acid Openeye Name: 4-[[[10-[(4-carboxyphenyl)methylamino]-10-oxo-decanoyl]amino]methyl]benzoic acid CAS Name: 4-[[[10-[(4-carboxyphenyl)methylamino]-1,10-dioxodecyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[10-[(4-carboxyphenyl)methylamino]-10-oxodecanoyl]amino]methyl]benzoic acid Traditional Name: 4-[[[10-[(4-carboxybenzyl)amino]-10-keto-decanoyl]amino]methyl]benzoic acid Formula: C26H32N2O6 MolecularWeight: 468.54208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CCCCCCCCC(=O)NCC2=CC=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CCCCCCCCC(=O)NCC2=CC=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C26H32N2O6/c29-23(27-17-19-9-13-21(14-10-19)25(31)32)7-5-3-1-2-4-6-8-24(30)28-18-20-11-15-22(16-12-20)26(33)34/h9-16H,1-8,17-18H2,(H,27,29)(H,28,30)(H,31,32)(H,33,34)