4-(10-cyano-3-methyl-6-oxidanylidene-3,4-dihydro-2H-1,5-benzoxazocin-5-yl)-3-(3,4-dichlorophenyl)butanamide

Systemtic Name: 4-(10-cyano-3-methyl-6-oxidanylidene-3,4-dihydro-2H-1,5-benzoxazocin-5-yl)-3-(3,4-dichlorophenyl)butanamide Openeye Name: 4-(10-cyano-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-5-yl)-3-(3,4-dichlorophenyl)butanamide CAS Name: 4-(10-cyano-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-5-yl)-3-(3,4-dichlorophenyl)butanamide IUPAC Name: 4-(10-cyano-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-5-yl)-3-(3,4-dichlorophenyl)butanamide Traditional Name: 4-(10-cyano-6-keto-3-methyl-3,4-dihydro-2H-1,5-benzoxazocin-5-yl)-3-(3,4-dichlorophenyl)butyramide Formula: C22H21Cl2N3O3 MolecularWeight: 446.32644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(=O)C2=CC=CC(=C2OC1)C#N)CC(CC(=O)N)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC1CN(C(=O)C2=CC=CC(=C2OC1)C#N)CC(CC(=O)N)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H21Cl2N3O3/c1-13-10-27(22(29)17-4-2-3-15(9-25)21(17)30-12-13)11-16(8-20(26)28)14-5-6-18(23)19(24)7-14/h2-7,13,16H,8,10-12H2,1H3,(H2,26,28)