1-(4-fluoranyl-3-nitro-phenyl)sulfonyl-4-(2-methylphenyl)piperazine

Systemtic Name: 1-(4-fluoranyl-3-nitro-phenyl)sulfonyl-4-(2-methylphenyl)piperazine Openeye Name: 1-(4-fluoro-3-nitro-phenyl)sulfonyl-4-(o-tolyl)piperazine CAS Name: 1-(4-fluoro-3-nitrophenyl)sulfonyl-4-(2-methylphenyl)piperazine IUPAC Name: 1-(4-fluoro-3-nitrophenyl)sulfonyl-4-(2-methylphenyl)piperazine Traditional Name: 1-(4-fluoro-3-nitro-phenyl)sulfonyl-4-(o-tolyl)piperazine Formula: C17H18FN3O4S MolecularWeight: 379.405923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H18FN3O4S/c1-13-4-2-3-5-16(13)19-8-10-20(11-9-19)26(24,25)14-6-7-15(18)17(12-14)21(22)23/h2-7,12H,8-11H2,1H3