2-[[2-[(4-phenylazanylphenyl)carbamoyl]phenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[2-[(4-phenylazanylphenyl)carbamoyl]phenyl]carbamoyl]benzoic acid Openeye Name: 2-[[2-[(4-anilinophenyl)carbamoyl]phenyl]carbamoyl]benzoic acid CAS Name: 2-[[2-[(4-anilinoanilino)-oxomethyl]anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[2-[(4-anilinophenyl)carbamoyl]phenyl]carbamoyl]benzoic acid Traditional Name: 2-[[2-[(4-anilinophenyl)carbamoyl]phenyl]carbamoyl]benzoic acid Formula: C27H21N3O4 MolecularWeight: 451.47334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C27H21N3O4/c31-25(21-10-4-5-11-22(21)27(33)34)30-24-13-7-6-12-23(24)26(32)29-20-16-14-19(15-17-20)28-18-8-2-1-3-9-18/h1-17,28H,(H,29,32)(H,30,31)(H,33,34)