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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-(4-methoxyphenyl)-4-nitro-benzamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-(4-methoxyphenyl)-4-nitro-benzamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-(4-methoxyphenyl)-4-nitrobenzamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-(4-methoxyphenyl)-4-nitrobenzamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N-(4-methoxyphenyl)-4-nitro-benzamide Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(C2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N(C2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O6S/c1-26-17-8-6-14(7-9-17)19(16-10-11-27(24,25)12-16)18(21)13-2-4-15(5-3-13)20(22)23/h2-9,16H,10-12H2,1H3