[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: [4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Openeye Name: [4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone CAS Name: [4-(4-nitrophenyl)sulfonyl-1-piperazinyl]-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: [4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Traditional Name: (4-nosylpiperazino)-(3,4,5-trimethoxyphenyl)methanone Formula: C20H23N3O8S MolecularWeight: 465.47692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O8S/c1-29-17-12-14(13-18(30-2)19(17)31-3)20(24)21-8-10-22(11-9-21)32(27,28)16-6-4-15(5-7-16)23(25)26/h4-7,12-13H,8-11H2,1-3H3