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

Systemtic Name: 2-[3-[tert-butyl-[(3-chlorophenyl)carbamoyl]amino]-2-oxidanylidene-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoate Openeye Name: 2-[3-[tert-butyl-[(3-chlorophenyl)carbamoyl]amino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetate CAS Name: 2-[3-[tert-butyl-[(3-chloroanilino)-oxomethyl]amino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetate IUPAC Name: 2-[3-[tert-butyl-[(3-chlorophenyl)carbamoyl]amino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetate Traditional Name: 2-[3-[tert-butyl-[(3-chlorophenyl)carbamoyl]amino]-2-keto-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetate Formula: C29H29ClN3O4- MolecularWeight: 519.01126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C1CC(C2=CC=CC=C2N(C1=O)CC(=O)[O-])C3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C)(C)N(C1CC(C2=CC=CC=C2N(C1=O)CC(=O)[O-])C3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C29H30ClN3O4/c1-29(2,3)33(28(37)31-21-13-9-12-20(30)16-21)25-17-23(19-10-5-4-6-11-19)22-14-7-8-15-24(22)32(27(25)36)18-26(34)35/h4-16,23,25H,17-18H2,1-3H3,(H,31,37)(H,34,35)/p-1