(4S)-4-(2,4-dichlorophenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile

Systemtic Name: (4S)-4-(2,4-dichlorophenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Openeye Name: (4S)-4-(2,4-dichlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile CAS Name: (4S)-4-(2,4-dichlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile IUPAC Name: (4S)-4-(2,4-dichlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Traditional Name: (4S)-4-(2,4-dichlorophenyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Formula: C17H14Cl2N2O MolecularWeight: 333.21186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C#N)C3=C(C=C(C=C3)Cl)Cl)C(=O)CCC2

Isomeric SMILES

CC1=NC2=C([C@H](C1C#N)C3=C(C=C(C=C3)Cl)Cl)C(=O)CCC2

InChI

InChI=1S/C17H14Cl2N2O/c1-9-12(8-20)16(11-6-5-10(18)7-13(11)19)17-14(21-9)3-2-4-15(17)22/h5-7,12,16H,2-4H2,1H3/t12?,16-/m0/s1