1-(2,3-dimethylphenyl)-4-(3-nitrophenyl)sulfonyl-piperazine

Systemtic Name: 1-(2,3-dimethylphenyl)-4-(3-nitrophenyl)sulfonyl-piperazine Openeye Name: 1-(2,3-dimethylphenyl)-4-(3-nitrophenyl)sulfonyl-piperazine CAS Name: 1-(2,3-dimethylphenyl)-4-(3-nitrophenyl)sulfonylpiperazine IUPAC Name: 1-(2,3-dimethylphenyl)-4-(3-nitrophenyl)sulfonylpiperazine Traditional Name: 1-(2,3-dimethylphenyl)-4-(3-nitrophenyl)sulfonyl-piperazine Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O4S/c1-14-5-3-8-18(15(14)2)19-9-11-20(12-10-19)26(24,25)17-7-4-6-16(13-17)21(22)23/h3-8,13H,9-12H2,1-2H3