4-(4-chloranyl-3-nitro-phenyl)-2-methyl-3-methylsulfonyl-4,6,7,8-tetrahydro-1H-quinolin-5-one

Systemtic Name: 4-(4-chloranyl-3-nitro-phenyl)-2-methyl-3-methylsulfonyl-4,6,7,8-tetrahydro-1H-quinolin-5-one Openeye Name: 4-(4-chloro-3-nitro-phenyl)-2-methyl-3-methylsulfonyl-4,6,7,8-tetrahydro-1H-quinolin-5-one CAS Name: 4-(4-chloro-3-nitrophenyl)-2-methyl-3-methylsulfonyl-4,6,7,8-tetrahydro-1H-quinolin-5-one IUPAC Name: 4-(4-chloro-3-nitrophenyl)-2-methyl-3-methylsulfonyl-4,6,7,8-tetrahydro-1H-quinolin-5-one Traditional Name: 4-(4-chloro-3-nitro-phenyl)-3-mesyl-2-methyl-4,6,7,8-tetrahydro-1H-quinolin-5-one Formula: C17H17ClN2O5S MolecularWeight: 396.84528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C17H17ClN2O5S/c1-9-17(26(2,24)25)15(16-12(19-9)4-3-5-14(16)21)10-6-7-11(18)13(8-10)20(22)23/h6-8,15,19H,3-5H2,1-2H3