1-(3-methoxy-4-nitro-phenyl)-4-(phenylsulfonyl)piperazine

Systemtic Name: 1-(3-methoxy-4-nitro-phenyl)-4-(phenylsulfonyl)piperazine Openeye Name: 1-(benzenesulfonyl)-4-(3-methoxy-4-nitro-phenyl)piperazine CAS Name: 1-(benzenesulfonyl)-4-(3-methoxy-4-nitrophenyl)piperazine IUPAC Name: 1-(benzenesulfonyl)-4-(3-methoxy-4-nitrophenyl)piperazine Traditional Name: 1-besyl-4-(3-methoxy-4-nitro-phenyl)piperazine Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O5S/c1-25-17-13-14(7-8-16(17)20(21)22)18-9-11-19(12-10-18)26(23,24)15-5-3-2-4-6-15/h2-8,13H,9-12H2,1H3