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

Systemtic Name: (3,4-dimethylphenyl)-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3,4-dimethylphenyl)-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (3,4-dimethylphenyl)-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (3,4-dimethylphenyl)-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3,4-dimethylphenyl)-(4-nosylpiperazino)methanone Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H21N3O5S/c1-14-3-4-16(13-15(14)2)19(23)20-9-11-21(12-10-20)28(26,27)18-7-5-17(6-8-18)22(24)25/h3-8,13H,9-12H2,1-2H3