2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 2,4-dimethoxybenzoate

Systemtic Name: 2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 2,4-dimethoxybenzoate Openeye Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 2,4-dimethoxybenzoate CAS Name: 2,4-dimethoxybenzoic acid 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl ester IUPAC Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 2,4-dimethoxybenzoate Traditional Name: 2,4-dimethoxybenzoic acid 2-(1,1,3-triketo-1,2-benzothiazol-2-yl)ethyl ester Formula: C18H17NO7S MolecularWeight: 391.39508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3S2(=O)=O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3S2(=O)=O)OC

InChI

InChI=1S/C18H17NO7S/c1-24-12-7-8-13(15(11-12)25-2)18(21)26-10-9-19-17(20)14-5-3-4-6-16(14)27(19,22)23/h3-8,11H,9-10H2,1-2H3