1-(3-methoxyphenyl)-4-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)piperazine

Systemtic Name: 1-(3-methoxyphenyl)-4-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)piperazine Openeye Name: 1-(3-methoxyphenyl)-4-[2-nitro-4-(1-piperidylsulfonyl)phenyl]piperazine CAS Name: 1-(3-methoxyphenyl)-4-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]piperazine IUPAC Name: 1-(3-methoxyphenyl)-4-(2-nitro-4-piperidin-1-ylsulfonylphenyl)piperazine Traditional Name: 1-(3-methoxyphenyl)-4-(2-nitro-4-piperidinosulfonyl-phenyl)piperazine Formula: C22H28N4O5S MolecularWeight: 460.54652

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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)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O5S/c1-31-19-7-5-6-18(16-19)23-12-14-24(15-13-23)21-9-8-20(17-22(21)26(27)28)32(29,30)25-10-3-2-4-11-25/h5-9,16-17H,2-4,10-15H2,1H3