5-(3,4-dimethoxyphenyl)carbonyl-3H-1,3-benzothiazol-2-one

Systemtic Name: 5-(3,4-dimethoxyphenyl)carbonyl-3H-1,3-benzothiazol-2-one Openeye Name: 5-(3,4-dimethoxybenzoyl)-3H-1,3-benzothiazol-2-one CAS Name: 5-[(3,4-dimethoxyphenyl)-oxomethyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 5-(3,4-dimethoxybenzoyl)-3H-1,3-benzothiazol-2-one Traditional Name: 5-veratroyl-3H-1,3-benzothiazol-2-one Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2=CC3=C(C=C2)SC(=O)N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C2=CC3=C(C=C2)SC(=O)N3)OC

InChI

InChI=1S/C16H13NO4S/c1-20-12-5-3-10(8-13(12)21-2)15(18)9-4-6-14-11(7-9)17-16(19)22-14/h3-8H,1-2H3,(H,17,19)