N-[(3R)-1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-N-(4-methylphenyl)-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[(3R)-1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-N-(4-methylphenyl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]-3-nitro-4-(1-piperidyl)-N-(p-tolyl)benzamide CAS Name: N-[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]-N-(4-methylphenyl)-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]-N-(4-methylphenyl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[(3R)-1,1-diketo-2,3-dihydrothiophen-3-yl]-3-nitro-4-piperidino-N-(p-tolyl)benzamide Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2CS(=O)(=O)C=C2)C(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N([C@H]2CS(=O)(=O)C=C2)C(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O5S/c1-17-5-8-19(9-6-17)25(20-11-14-32(30,31)16-20)23(27)18-7-10-21(22(15-18)26(28)29)24-12-3-2-4-13-24/h5-11,14-15,20H,2-4,12-13,16H2,1H3/t20-/m1/s1