1,3-benzothiazol-2-ylmethyl 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-oxidanylidenechromene-3-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H11NO4S MolecularWeight: 337.34924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H11NO4S/c20-17(12-9-11-5-1-3-7-14(11)23-18(12)21)22-10-16-19-13-6-2-4-8-15(13)24-16/h1-9H,10H2