1-(2,5-dimethoxy-4-nitro-phenyl)sulfonyl-4-(phenylmethyl)piperazine

Systemtic Name: 1-(2,5-dimethoxy-4-nitro-phenyl)sulfonyl-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-(2,5-dimethoxy-4-nitro-phenyl)sulfonyl-piperazine CAS Name: 1-(2,5-dimethoxy-4-nitrophenyl)sulfonyl-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-(2,5-dimethoxy-4-nitrophenyl)sulfonylpiperazine Traditional Name: 1-benzyl-4-(2,5-dimethoxy-4-nitro-phenyl)sulfonyl-piperazine Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1[N+](=O)[O-])OC)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1[N+](=O)[O-])OC)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H23N3O6S/c1-27-17-13-19(18(28-2)12-16(17)22(23)24)29(25,26)21-10-8-20(9-11-21)14-15-6-4-3-5-7-15/h3-7,12-13H,8-11,14H2,1-2H3