1-(3-methoxyphenyl)-4-(4-methylsulfonyl-2-nitro-phenyl)piperazine

Systemtic Name: 1-(3-methoxyphenyl)-4-(4-methylsulfonyl-2-nitro-phenyl)piperazine Openeye Name: 1-(3-methoxyphenyl)-4-(4-methylsulfonyl-2-nitro-phenyl)piperazine CAS Name: 1-(3-methoxyphenyl)-4-(4-methylsulfonyl-2-nitrophenyl)piperazine IUPAC Name: 1-(3-methoxyphenyl)-4-(4-methylsulfonyl-2-nitrophenyl)piperazine Traditional Name: 1-(4-mesyl-2-nitro-phenyl)-4-(3-methoxyphenyl)piperazine Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

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