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

Systemtic Name: N-[4-[1,1-bis(oxidanylidene)-1,2-thiazinan-2-yl]phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[4-(1,1-dioxothiazinan-2-yl)phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[4-(1,1-dioxo-2-thiazinanyl)phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[4-(1,1-dioxothiazinan-2-yl)phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[4-(1,1-diketothiazinan-2-yl)phenyl]-4-methyl-3-nitro-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=C(C=C2)N3CCCCS3(=O)=O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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