2-[(4-methoxyphenyl)methyl]-1,1-bis(oxidanylidene)-3H-1,2-benzothiazole-3-carbonitrile

Systemtic Name: 2-[(4-methoxyphenyl)methyl]-1,1-bis(oxidanylidene)-3H-1,2-benzothiazole-3-carbonitrile Openeye Name: 2-[(4-methoxyphenyl)methyl]-1,1-dioxo-3H-1,2-benzothiazole-3-carbonitrile CAS Name: 2-[(4-methoxyphenyl)methyl]-1,1-dioxo-3H-1,2-benzothiazole-3-carbonitrile IUPAC Name: 2-[(4-methoxyphenyl)methyl]-1,1-dioxo-3H-1,2-benzothiazole-3-carbonitrile Traditional Name: 1,1-diketo-2-p-anisyl-3H-1,2-benzothiazole-3-carbonitrile Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(C3=CC=CC=C3S2(=O)=O)C#N

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(C3=CC=CC=C3S2(=O)=O)C#N

InChI

InChI=1S/C16H14N2O3S/c1-21-13-8-6-12(7-9-13)11-18-15(10-17)14-4-2-3-5-16(14)22(18,19)20/h2-9,15H,11H2,1H3