ethyl 3-(1,3-benzothiazol-2-yl)-7-(3,4-dimethoxyphenyl)carbonyloxy-6-ethyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-yl)-7-(3,4-dimethoxyphenyl)carbonyloxy-6-ethyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 3-(1,3-benzothiazol-2-yl)-7-(3,4-dimethoxybenzoyl)oxy-6-ethyl-4-oxo-chromene-2-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-7-[(3,4-dimethoxyphenyl)-oxomethoxy]-6-ethyl-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzothiazol-2-yl)-7-(3,4-dimethoxybenzoyl)oxy-6-ethyl-4-oxochromene-2-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)-6-ethyl-4-keto-7-veratroyloxy-chromene-2-carboxylic acid ethyl ester Formula: C30H25NO8S MolecularWeight: 559.5864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(=O)OCC)C3=NC4=CC=CC=C4S3)OC(=O)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(=O)OCC)C3=NC4=CC=CC=C4S3)OC(=O)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C30H25NO8S/c1-5-16-13-18-22(15-21(16)39-29(33)17-11-12-20(35-3)23(14-17)36-4)38-27(30(34)37-6-2)25(26(18)32)28-31-19-9-7-8-10-24(19)40-28/h7-15H,5-6H2,1-4H3