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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-(3-methylphenyl)-4-nitro-benzamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-(m-tolyl)-4-nitro-benzamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-(3-methylphenyl)-4-nitrobenzamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-(3-methylphenyl)-4-nitrobenzamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N-(m-tolyl)-4-nitro-benzamide Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O5S/c1-13-3-2-4-16(11-13)19(17-9-10-26(24,25)12-17)18(21)14-5-7-15(8-6-14)20(22)23/h2-8,11,17H,9-10,12H2,1H3