[3-(1,3-benzothiazol-2-yl)-4-oxidanylidene-chromen-7-yl] 3,4-dimethoxybenzoate

Systemtic Name: [3-(1,3-benzothiazol-2-yl)-4-oxidanylidene-chromen-7-yl] 3,4-dimethoxybenzoate Openeye Name: [3-(1,3-benzothiazol-2-yl)-4-oxo-chromen-7-yl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [3-(1,3-benzothiazol-2-yl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzothiazol-2-yl)-4-oxochromen-7-yl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [3-(1,3-benzothiazol-2-yl)-4-keto-chromen-7-yl] ester Formula: C25H17NO6S MolecularWeight: 459.47058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=NC5=CC=CC=C5S4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=NC5=CC=CC=C5S4)OC

InChI

InChI=1S/C25H17NO6S/c1-29-19-10-7-14(11-21(19)30-2)25(28)32-15-8-9-16-20(12-15)31-13-17(23(16)27)24-26-18-5-3-4-6-22(18)33-24/h3-13H,1-2H3