4-[4-iodanyl-2,6-dimethyl-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-3-yl]butanenitrile

Systemtic Name: 4-[4-iodanyl-2,6-dimethyl-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-3-yl]butanenitrile Openeye Name: 4-(4-iodo-2,6-dimethyl-1,1-dioxo-1$l^{6},2-benzothiazin-3-yl)butanenitrile CAS Name: 4-(4-iodo-2,6-dimethyl-1,1-dioxo-1$l^{6},2-benzothiazin-3-yl)butanenitrile IUPAC Name: 4-(4-iodo-2,6-dimethyl-1,1-dioxo-1$l^{6},2-benzothiazin-3-yl)butanenitrile Traditional Name: 4-(4-iodo-1,1-diketo-2,6-dimethyl-1$l^{6},2-benzothiazin-3-yl)butyronitrile Formula: C14H15IN2O2S MolecularWeight: 402.25057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)S(=O)(=O)N(C(=C2I)CCCC#N)C

Isomeric SMILES

CC1=CC2=C(C=C1)S(=O)(=O)N(C(=C2I)CCCC#N)C

InChI

InChI=1S/C14H15IN2O2S/c1-10-6-7-13-11(9-10)14(15)12(5-3-4-8-16)17(2)20(13,18)19/h6-7,9H,3-5H2,1-2H3