(3R)-1-(4-methylphenyl)sulfonyl-N-[(Z)-(3-nitrophenyl)methylideneamino]piperidine-3-carboxamide

Systemtic Name: (3R)-1-(4-methylphenyl)sulfonyl-N-[(Z)-(3-nitrophenyl)methylideneamino]piperidine-3-carboxamide Openeye Name: (3R)-N-[(Z)-(3-nitrophenyl)methyleneamino]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: (3R)-1-(4-methylphenyl)sulfonyl-N-[(Z)-(3-nitrophenyl)methylideneamino]-3-piperidinecarboxamide IUPAC Name: (3R)-1-(4-methylphenyl)sulfonyl-N-[(Z)-(3-nitrophenyl)methylideneamino]piperidine-3-carboxamide Traditional Name: (3R)-N-[(Z)-(3-nitrobenzylidene)amino]-1-tosyl-nipecotamide Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)N/N=C\C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5S/c1-15-7-9-19(10-8-15)30(28,29)23-11-3-5-17(14-23)20(25)22-21-13-16-4-2-6-18(12-16)24(26)27/h2,4,6-10,12-13,17H,3,5,11,14H2,1H3,(H,22,25)/b21-13-/t17-/m1/s1