1,3-benzothiazol-2-ylmethyl 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate Traditional Name: 2-(1,3-diketo-4H-isoquinolin-2-yl)acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H14N2O4S MolecularWeight: 366.39046

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CC(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H14N2O4S/c22-17-9-12-5-1-2-6-13(12)19(24)21(17)10-18(23)25-11-16-20-14-7-3-4-8-15(14)26-16/h1-8H,9-11H2