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

Systemtic Name: [4-(2-chlorophenyl)sulfanyl-3-nitro-phenyl]-piperidin-1-yl-methanone Openeye Name: [4-(2-chlorophenyl)sulfanyl-3-nitro-phenyl]-(1-piperidyl)methanone CAS Name: [4-[(2-chlorophenyl)thio]-3-nitrophenyl]-(1-piperidinyl)methanone IUPAC Name: [4-(2-chlorophenyl)sulfanyl-3-nitrophenyl]-piperidin-1-ylmethanone Traditional Name: [4-[(2-chlorophenyl)thio]-3-nitro-phenyl]-piperidino-methanone Formula: C18H17ClN2O3S MolecularWeight: 376.85718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN2O3S/c19-14-6-2-3-7-16(14)25-17-9-8-13(12-15(17)21(23)24)18(22)20-10-4-1-5-11-20/h2-3,6-9,12H,1,4-5,10-11H2