4-(4-methylphenyl)sulfonyl-N-(4-nitrophenyl)piperazine-1-carboxamide

Systemtic Name: 4-(4-methylphenyl)sulfonyl-N-(4-nitrophenyl)piperazine-1-carboxamide Openeye Name: N-(4-nitrophenyl)-4-(p-tolylsulfonyl)piperazine-1-carboxamide CAS Name: 4-(4-methylphenyl)sulfonyl-N-(4-nitrophenyl)-1-piperazinecarboxamide IUPAC Name: 4-(4-methylphenyl)sulfonyl-N-(4-nitrophenyl)piperazine-1-carboxamide Traditional Name: N-(4-nitrophenyl)-4-tosyl-piperazine-1-carboxamide Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O5S/c1-14-2-8-17(9-3-14)28(26,27)21-12-10-20(11-13-21)18(23)19-15-4-6-16(7-5-15)22(24)25/h2-9H,10-13H2,1H3,(H,19,23)