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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-(4-methylphenyl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-3-nitro-4-(1-piperidyl)-N-(p-tolyl)benzamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-(4-methylphenyl)-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-(4-methylphenyl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(1,1-diketothiolan-3-yl)-3-nitro-4-piperidino-N-(p-tolyl)benzamide Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2CCS(=O)(=O)C2)C(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N(C2CCS(=O)(=O)C2)C(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H27N3O5S/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/h5-10,15,20H,2-4,11-14,16H2,1H3