(2-ethylpiperidin-1-yl)-[4-(4-fluorophenyl)sulfanyl-3-nitro-phenyl]methanone

Systemtic Name: (2-ethylpiperidin-1-yl)-[4-(4-fluorophenyl)sulfanyl-3-nitro-phenyl]methanone Openeye Name: (2-ethyl-1-piperidyl)-[4-(4-fluorophenyl)sulfanyl-3-nitro-phenyl]methanone CAS Name: (2-ethyl-1-piperidinyl)-[4-[(4-fluorophenyl)thio]-3-nitrophenyl]methanone IUPAC Name: (2-ethylpiperidin-1-yl)-[4-(4-fluorophenyl)sulfanyl-3-nitrophenyl]methanone Traditional Name: (2-ethylpiperidino)-[4-[(4-fluorophenyl)thio]-3-nitro-phenyl]methanone Formula: C20H21FN2O3S MolecularWeight: 388.455743

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H21FN2O3S/c1-2-16-5-3-4-12-22(16)20(24)14-6-11-19(18(13-14)23(25)26)27-17-9-7-15(21)8-10-17/h6-11,13,16H,2-5,12H2,1H3