4-(3-chloranyl-4-methoxy-phenyl)-1,1-bis(oxidanylidene)-1$l^{6},4-benzothiazine-2-carbonitrile

Systemtic Name: 4-(3-chloranyl-4-methoxy-phenyl)-1,1-bis(oxidanylidene)-1$l^{6},4-benzothiazine-2-carbonitrile Openeye Name: 4-(3-chloro-4-methoxy-phenyl)-1,1-dioxo-1$l^{6},4-benzothiazine-2-carbonitrile CAS Name: 4-(3-chloro-4-methoxyphenyl)-1,1-dioxo-1$l^{6},4-benzothiazine-2-carbonitrile IUPAC Name: 4-(3-chloro-4-methoxyphenyl)-1,1-dioxo-1$l^{6},4-benzothiazine-2-carbonitrile Traditional Name: 4-(3-chloro-4-methoxy-phenyl)-1,1-diketo-1$l^{6},4-benzothiazine-2-carbonitrile Formula: C16H11ClN2O3S MolecularWeight: 346.78814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C=C(S(=O)(=O)C3=CC=CC=C32)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C=C(S(=O)(=O)C3=CC=CC=C32)C#N)Cl

InChI

InChI=1S/C16H11ClN2O3S/c1-22-15-7-6-11(8-13(15)17)19-10-12(9-18)23(20,21)16-5-3-2-4-14(16)19/h2-8,10H,1H3