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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-(tert-butylamino)-N-methyl-3-nitro-benzamide Openeye Name: 4-(tert-butylamino)-N-(1,1-dioxothiolan-3-yl)-N-methyl-3-nitro-benzamide CAS Name: 4-(tert-butylamino)-N-(1,1-dioxo-3-thiolanyl)-N-methyl-3-nitrobenzamide IUPAC Name: 4-(tert-butylamino)-N-(1,1-dioxothiolan-3-yl)-N-methyl-3-nitrobenzamide Traditional Name: 4-(tert-butylamino)-N-(1,1-diketothiolan-3-yl)-N-methyl-3-nitro-benzamide Formula: C16H23N3O5S MolecularWeight: 369.43592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C=C(C=C1)C(=O)N(C)C2CCS(=O)(=O)C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC1=C(C=C(C=C1)C(=O)N(C)C2CCS(=O)(=O)C2)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O5S/c1-16(2,3)17-13-6-5-11(9-14(13)19(21)22)15(20)18(4)12-7-8-25(23,24)10-12/h5-6,9,12,17H,7-8,10H2,1-4H3