[4-(3-chlorophenyl)sulfonyl-3-nitro-phenyl]-(2-methylpiperidin-1-yl)methanone

Systemtic Name: [4-(3-chlorophenyl)sulfonyl-3-nitro-phenyl]-(2-methylpiperidin-1-yl)methanone Openeye Name: [4-(3-chlorophenyl)sulfonyl-3-nitro-phenyl]-(2-methyl-1-piperidyl)methanone CAS Name: [4-(3-chlorophenyl)sulfonyl-3-nitrophenyl]-(2-methyl-1-piperidinyl)methanone IUPAC Name: [4-(3-chlorophenyl)sulfonyl-3-nitrophenyl]-(2-methylpiperidin-1-yl)methanone Traditional Name: [4-(3-chlorophenyl)sulfonyl-3-nitro-phenyl]-(2-methylpiperidino)methanone Formula: C19H19ClN2O5S MolecularWeight: 422.88256

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1C(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN2O5S/c1-13-5-2-3-10-21(13)19(23)14-8-9-18(17(11-14)22(24)25)28(26,27)16-7-4-6-15(20)12-16/h4,6-9,11-13H,2-3,5,10H2,1H3