[2-(2-chloranyl-4-nitro-phenyl)sulfanylphenyl]-piperidin-1-yl-methanone

Systemtic Name: [2-(2-chloranyl-4-nitro-phenyl)sulfanylphenyl]-piperidin-1-yl-methanone Openeye Name: [2-(2-chloro-4-nitro-phenyl)sulfanylphenyl]-(1-piperidyl)methanone CAS Name: [2-[(2-chloro-4-nitrophenyl)thio]phenyl]-(1-piperidinyl)methanone IUPAC Name: [2-(2-chloro-4-nitrophenyl)sulfanylphenyl]-piperidin-1-ylmethanone Traditional Name: [2-[(2-chloro-4-nitro-phenyl)thio]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=CC=C2SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=CC=C2SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

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