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

Systemtic Name: [4-(2-chlorophenyl)sulfanyl-3-nitro-phenyl]-(2-methylpiperidin-1-yl)methanone Openeye Name: [4-(2-chlorophenyl)sulfanyl-3-nitro-phenyl]-(2-methyl-1-piperidyl)methanone CAS Name: [4-[(2-chlorophenyl)thio]-3-nitrophenyl]-(2-methyl-1-piperidinyl)methanone IUPAC Name: [4-(2-chlorophenyl)sulfanyl-3-nitrophenyl]-(2-methylpiperidin-1-yl)methanone Traditional Name: [4-[(2-chlorophenyl)thio]-3-nitro-phenyl]-(2-methylpiperidino)methanone Formula: C19H19ClN2O3S MolecularWeight: 390.88376

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1C(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN2O3S/c1-13-6-4-5-11-21(13)19(23)14-9-10-18(16(12-14)22(24)25)26-17-8-3-2-7-15(17)20/h2-3,7-10,12-13H,4-6,11H2,1H3