N-[2-azanyl-3-cyano-4-(4-ethylphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinolin-1-yl]-4-chloranyl-benzamide

Systemtic Name: N-[2-azanyl-3-cyano-4-(4-ethylphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinolin-1-yl]-4-chloranyl-benzamide Openeye Name: N-[2-amino-3-cyano-4-(4-ethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-4-chloro-benzamide CAS Name: N-[2-amino-3-cyano-4-(4-ethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-4-chlorobenzamide IUPAC Name: N-[2-amino-3-cyano-4-(4-ethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-4-chlorobenzamide Traditional Name: N-[2-amino-3-cyano-4-(4-ethylphenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinolin-1-yl]-4-chloro-benzamide Formula: C27H27ClN4O2 MolecularWeight: 474.98188

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)NC(=O)C4=CC=C(C=C4)Cl)N)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)NC(=O)C4=CC=C(C=C4)Cl)N)C#N

InChI

InChI=1S/C27H27ClN4O2/c1-4-16-5-7-17(8-6-16)23-20(15-29)25(30)32(21-13-27(2,3)14-22(33)24(21)23)31-26(34)18-9-11-19(28)12-10-18/h5-12,23H,4,13-14,30H2,1-3H3,(H,31,34)