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

Systemtic Name: [3-[(4-chlorophenyl)sulfonylmethyl]-4-nitro-phenyl]-piperidin-1-yl-methanone Openeye Name: [3-[(4-chlorophenyl)sulfonylmethyl]-4-nitro-phenyl]-(1-piperidyl)methanone CAS Name: [3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrophenyl]-(1-piperidinyl)methanone IUPAC Name: [3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrophenyl]-piperidin-1-ylmethanone Traditional Name: [3-[(4-chlorophenyl)sulfonylmethyl]-4-nitro-phenyl]-piperidino-methanone Formula: C19H19ClN2O5S MolecularWeight: 422.88256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])CS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])CS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H19ClN2O5S/c20-16-5-7-17(8-6-16)28(26,27)13-15-12-14(4-9-18(15)22(24)25)19(23)21-10-2-1-3-11-21/h4-9,12H,1-3,10-11,13H2