ethyl 3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxidanylidene-7-(phenylcarbonyloxy)chromene-2-carboxylate

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxidanylidene-7-(phenylcarbonyloxy)chromene-2-carboxylate Openeye Name: ethyl 3-(1,3-benzothiazol-2-yl)-7-benzoyloxy-8-methyl-4-oxo-chromene-2-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-7-benzoyloxy-8-methyl-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzothiazol-2-yl)-7-benzoyloxy-8-methyl-4-oxochromene-2-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)-7-benzoyloxy-4-keto-8-methyl-chromene-2-carboxylic acid ethyl ester Formula: C27H19NO6S MolecularWeight: 485.50786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(O1)C(=C(C=C2)OC(=O)C3=CC=CC=C3)C)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(O1)C(=C(C=C2)OC(=O)C3=CC=CC=C3)C)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H19NO6S/c1-3-32-27(31)24-21(25-28-18-11-7-8-12-20(18)35-25)22(29)17-13-14-19(15(2)23(17)34-24)33-26(30)16-9-5-4-6-10-16/h4-14H,3H2,1-2H3