1-(4-methylphenyl)-N-(3-nitrophenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide

Systemtic Name: 1-(4-methylphenyl)-N-(3-nitrophenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide Openeye Name: N-(3-nitrophenyl)-6-oxo-1-(p-tolyl)-2-(2-thienyl)piperidine-3-carboxamide CAS Name: 1-(4-methylphenyl)-N-(3-nitrophenyl)-6-oxo-2-thiophen-2-yl-3-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)-N-(3-nitrophenyl)-6-oxo-2-thiophen-2-ylpiperidine-3-carboxamide Traditional Name: 6-keto-N-(3-nitrophenyl)-1-(p-tolyl)-2-(2-thienyl)nipecotamide Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C23H21N3O4S/c1-15-7-9-17(10-8-15)25-21(27)12-11-19(22(25)20-6-3-13-31-20)23(28)24-16-4-2-5-18(14-16)26(29)30/h2-10,13-14,19,22H,11-12H2,1H3,(H,24,28)