N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-3-nitro-N-(phenylmethyl)benzamide

Systemtic Name: N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-3-nitro-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-3-nitro-benzamide CAS Name: N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-3-nitro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-3-nitrobenzamide Traditional Name: N-benzyl-N-(1,1-diketo-2,3-dihydrothiophen-3-yl)-3-nitro-benzamide Formula: C18H16N2O5S MolecularWeight: 372.39504

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CS1(=O)=O)N(CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(C=CS1(=O)=O)N(CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O5S/c21-18(15-7-4-8-16(11-15)20(22)23)19(12-14-5-2-1-3-6-14)17-9-10-26(24,25)13-17/h1-11,17H,12-13H2