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

Systemtic Name: 3,3-dimethyl-2-[3-[(3-methylphenyl)carbamoylamino]-2-oxidanylidene-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]butanoic acid Openeye Name: 3,3-dimethyl-2-[3-(m-tolylcarbamoylamino)-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]butanoic acid CAS Name: 3,3-dimethyl-2-[3-[[(3-methylanilino)-oxomethyl]amino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]butanoic acid IUPAC Name: 3,3-dimethyl-2-[3-[(3-methylphenyl)carbamoylamino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]butanoic acid Traditional Name: 2-[2-keto-3-(m-tolylcarbamoylamino)-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]-3,3-dimethyl-butyric acid Formula: C30H33N3O4 MolecularWeight: 499.60072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H33N3O4/c1-19-11-10-14-21(17-19)31-29(37)32-24-18-23(20-12-6-5-7-13-20)22-15-8-9-16-25(22)33(27(24)34)26(28(35)36)30(2,3)4/h5-17,23-24,26H,18H2,1-4H3,(H,35,36)(H2,31,32,37)