3-[1,1-bis(oxidanylidene)-1,2-thiazinan-2-yl]-4-methyl-N-(3-nitrophenyl)benzamide

Systemtic Name: 3-[1,1-bis(oxidanylidene)-1,2-thiazinan-2-yl]-4-methyl-N-(3-nitrophenyl)benzamide Openeye Name: 3-(1,1-dioxothiazinan-2-yl)-4-methyl-N-(3-nitrophenyl)benzamide CAS Name: 3-(1,1-dioxo-2-thiazinanyl)-4-methyl-N-(3-nitrophenyl)benzamide IUPAC Name: 3-(1,1-dioxothiazinan-2-yl)-4-methyl-N-(3-nitrophenyl)benzamide Traditional Name: 3-(1,1-diketothiazinan-2-yl)-4-methyl-N-(3-nitrophenyl)benzamide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])N3CCCCS3(=O)=O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])N3CCCCS3(=O)=O

InChI

InChI=1S/C18H19N3O5S/c1-13-7-8-14(11-17(13)20-9-2-3-10-27(20,25)26)18(22)19-15-5-4-6-16(12-15)21(23)24/h4-8,11-12H,2-3,9-10H2,1H3,(H,19,22)