(3R)-1-(4-methylphenyl)sulfonyl-N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]piperidine-3-carboxamide

Systemtic Name: (3R)-1-(4-methylphenyl)sulfonyl-N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]piperidine-3-carboxamide Openeye Name: (3R)-N-[(Z)-(5-nitro-2-furyl)methyleneamino]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: (3R)-1-(4-methylphenyl)sulfonyl-N-[(Z)-(5-nitro-2-furanyl)methylideneamino]-3-piperidinecarboxamide IUPAC Name: (3R)-1-(4-methylphenyl)sulfonyl-N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]piperidine-3-carboxamide Traditional Name: (3R)-N-[(Z)-(5-nitro-2-furyl)methyleneamino]-1-tosyl-nipecotamide Formula: C18H20N4O6S MolecularWeight: 420.4396

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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=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)N/N=C\C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O6S/c1-13-4-7-16(8-5-13)29(26,27)21-10-2-3-14(12-21)18(23)20-19-11-15-6-9-17(28-15)22(24)25/h4-9,11,14H,2-3,10,12H2,1H3,(H,20,23)/b19-11-/t14-/m1/s1