4-[(2-oxidanylidene-4-phenyl-1,3-dihydro-1,5-benzodiazepin-3-yl)amino]benzoic acid

Systemtic Name: 4-[(2-oxidanylidene-4-phenyl-1,3-dihydro-1,5-benzodiazepin-3-yl)amino]benzoic acid Openeye Name: 4-[(2-oxo-4-phenyl-1,3-dihydro-1,5-benzodiazepin-3-yl)amino]benzoic acid CAS Name: 4-[(2-oxo-4-phenyl-1,3-dihydro-1,5-benzodiazepin-3-yl)amino]benzoic acid IUPAC Name: 4-[(2-oxo-4-phenyl-1,3-dihydro-1,5-benzodiazepin-3-yl)amino]benzoic acid Traditional Name: 4-[(2-keto-4-phenyl-1,3-dihydro-1,5-benzodiazepin-3-yl)amino]benzoic acid Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3NC(=O)C2NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3NC(=O)C2NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C22H17N3O3/c26-21-20(23-16-12-10-15(11-13-16)22(27)28)19(14-6-2-1-3-7-14)24-17-8-4-5-9-18(17)25-21/h1-13,20,23H,(H,25,26)(H,27,28)