methyl (4R)-4-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate

Systemtic Name: methyl (4R)-4-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: methyl (4R)-4-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4R)-4-(5-cyano-1,2-dimethyl-3-pyrrolyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (4R)-4-(5-cyano-1,2-dimethylpyrrol-3-yl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4R)-4-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-5-keto-2-methyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid methyl ester Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=N1)CCCC2=O)C3=C(N(C(=C3)C#N)C)C)C(=O)OC

Isomeric SMILES

CC1=C([C@H](C2C(=N1)CCCC2=O)C3=C(N(C(=C3)C#N)C)C)C(=O)OC

InChI

InChI=1S/C19H21N3O3/c1-10-16(19(24)25-4)17(13-8-12(9-20)22(3)11(13)2)18-14(21-10)6-5-7-15(18)23/h8,17-18H,5-7H2,1-4H3/t17-,18?/m1/s1