[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-nitrophenyl)methanone

Systemtic Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-nitrophenyl)methanone Openeye Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-nitrophenyl)methanone CAS Name: [4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(2-nitrophenyl)methanone IUPAC Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-nitrophenyl)methanone Traditional Name: [4-(2,4-dimethylphenyl)sulfonylpiperazino]-(2-nitrophenyl)methanone Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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