3-azanyl-3-methyl-N-[1-(2-methyl-3-oxidanyl-4-phenyl-phenyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]butanamide

Systemtic Name: 3-azanyl-3-methyl-N-[1-(2-methyl-3-oxidanyl-4-phenyl-phenyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]butanamide Openeye Name: 3-amino-N-[1-(3-hydroxy-2-methyl-4-phenyl-phenyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]-3-methyl-butanamide CAS Name: 3-amino-N-[1-(3-hydroxy-2-methyl-4-phenylphenyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]-3-methylbutanamide IUPAC Name: 3-amino-N-[1-(3-hydroxy-2-methyl-4-phenylphenyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]-3-methylbutanamide Traditional Name: 3-amino-N-[1-(3-hydroxy-2-methyl-4-phenyl-phenyl)-2-keto-4,5-dihydro-3H-1-benzazepin-3-yl]-3-methyl-butyramide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)C2=CC=CC=C2)N3C4=CC=CC=C4CCC(C3=O)NC(=O)CC(C)(C)N

Isomeric SMILES

CC1=C(C=CC(=C1O)C2=CC=CC=C2)N3C4=CC=CC=C4CCC(C3=O)NC(=O)CC(C)(C)N

InChI

InChI=1S/C28H31N3O3/c1-18-23(16-14-21(26(18)33)19-9-5-4-6-10-19)31-24-12-8-7-11-20(24)13-15-22(27(31)34)30-25(32)17-28(2,3)29/h4-12,14,16,22,33H,13,15,17,29H2,1-3H3,(H,30,32)