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

Systemtic Name: 2-[3-[tert-butyl-[(4-methylphenyl)carbamoyl]amino]-2-oxidanylidene-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid Openeye Name: 2-[3-[tert-butyl(p-tolylcarbamoyl)amino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid CAS Name: 2-[3-[tert-butyl-[(4-methylanilino)-oxomethyl]amino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid IUPAC Name: 2-[3-[tert-butyl-[(4-methylphenyl)carbamoyl]amino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Traditional Name: 2-[3-[tert-butyl(p-tolylcarbamoyl)amino]-2-keto-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Formula: C30H33N3O4 MolecularWeight: 499.60072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N(C2CC(C3=CC=CC=C3N(C2=O)CC(=O)O)C4=CC=CC=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N(C2CC(C3=CC=CC=C3N(C2=O)CC(=O)O)C4=CC=CC=C4)C(C)(C)C

InChI

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