1-(3-methoxy-4-nitro-phenyl)-4-(4-methylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(3-methoxy-4-nitro-phenyl)-4-(4-methylphenyl)sulfonyl-piperazine Openeye Name: 1-(3-methoxy-4-nitro-phenyl)-4-(p-tolylsulfonyl)piperazine CAS Name: 1-(3-methoxy-4-nitrophenyl)-4-(4-methylphenyl)sulfonylpiperazine IUPAC Name: 1-(3-methoxy-4-nitrophenyl)-4-(4-methylphenyl)sulfonylpiperazine Traditional Name: 1-(3-methoxy-4-nitro-phenyl)-4-tosyl-piperazine Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H21N3O5S/c1-14-3-6-16(7-4-14)27(24,25)20-11-9-19(10-12-20)15-5-8-17(21(22)23)18(13-15)26-2/h3-8,13H,9-12H2,1-2H3