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

Systemtic Name: N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(3-methyl-1,1-dioxo-thiolan-3-yl)-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(3-methyl-1,1-dioxo-3-thiolanyl)-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(3-methyl-1,1-dioxothiolan-3-yl)-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(1,1-diketo-3-methyl-thiolan-3-yl)-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3(CCS(=O)(=O)C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3(CCS(=O)(=O)C3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O5S/c1-13-5-8-20(9-6-13)15-4-3-14(11-16(15)21(23)24)17(22)19-18(2)7-10-27(25,26)12-18/h3-4,11,13H,5-10,12H2,1-2H3,(H,19,22)