1-(4-methylphenyl)sulfonyl-N-[(E)-(4-nitrophenyl)methylideneamino]piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[(E)-(4-nitrophenyl)methylideneamino]piperidine-4-carboxamide Openeye Name: N-[(E)-(4-nitrophenyl)methyleneamino]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[(E)-(4-nitrophenyl)methylideneamino]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-[(E)-(4-nitrophenyl)methylideneamino]piperidine-4-carboxamide Traditional Name: N-[(E)-(4-nitrobenzylidene)amino]-1-tosyl-isonipecotamide Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NN=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N/N=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5S/c1-15-2-8-19(9-3-15)30(28,29)23-12-10-17(11-13-23)20(25)22-21-14-16-4-6-18(7-5-16)24(26)27/h2-9,14,17H,10-13H2,1H3,(H,22,25)/b21-14+