4-[[4-[(2-aminophenyl)carbamoyl]phenyl]methylcarbamoyl]benzoic acid hydrochloride

Systemtic Name: 4-[[4-[(2-aminophenyl)carbamoyl]phenyl]methylcarbamoyl]benzoic acid hydrochloride Openeye Name: 4-[[4-[(2-aminophenyl)carbamoyl]phenyl]methylcarbamoyl]benzoic acid hydrochloride CAS Name: 4-[[[4-[(2-aminoanilino)-oxomethyl]phenyl]methylamino]-oxomethyl]benzoic acid hydrochloride IUPAC Name: 4-[[4-[(2-aminophenyl)carbamoyl]phenyl]methylcarbamoyl]benzoic acid hydrochloride Traditional Name: 4-[[4-[(2-aminophenyl)carbamoyl]benzyl]carbamoyl]benzoic acid hydrochloride Formula: C22H20ClN3O4 MolecularWeight: 425.8649

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)C(=O)O.Cl

Isomeric SMILES

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)C(=O)O.Cl

InChI

InChI=1S/C22H19N3O4.ClH/c23-18-3-1-2-4-19(18)25-21(27)16-7-5-14(6-8-16)13-24-20(26)15-9-11-17(12-10-15)22(28)29;/h1-12H,13,23H2,(H,24,26)(H,25,27)(H,28,29);1H