1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-(2-nitrophenyl)ethanone

Systemtic Name: 1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-(2-nitrophenyl)ethanone Openeye Name: 1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-(2-nitrophenyl)ethanone CAS Name: 1-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-(2-nitrophenyl)ethanone IUPAC Name: 1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-(2-nitrophenyl)ethanone Traditional Name: 1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-2-(2-nitrophenyl)ethanone Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O7S/c1-29-18-8-7-16(14-19(18)30-2)31(27,28)22-11-9-21(10-12-22)20(24)13-15-5-3-4-6-17(15)23(25)26/h3-8,14H,9-13H2,1-2H3