2-[3-[(3-methylphenyl)carbamoylamino]-2-oxidanylidene-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(3-methylphenyl)carbamoylamino]-2-oxidanylidene-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid Openeye Name: 2-[3-(m-tolylcarbamoylamino)-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid CAS Name: 2-[3-[[(3-methylanilino)-oxomethyl]amino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid IUPAC Name: 2-[3-[(3-methylphenyl)carbamoylamino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Traditional Name: 2-[2-keto-3-(m-tolylcarbamoylamino)-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2CC(C3=CC=CC=C3N(C2=O)CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2CC(C3=CC=CC=C3N(C2=O)CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C26H25N3O4/c1-17-8-7-11-19(14-17)27-26(33)28-22-15-21(18-9-3-2-4-10-18)20-12-5-6-13-23(20)29(25(22)32)16-24(30)31/h2-14,21-22H,15-16H2,1H3,(H,30,31)(H2,27,28,33)