1,3-benzothiazol-2-ylmethyl 2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-(1-methylene-3-oxo-isoindolin-2-yl)acetate CAS Name: 2-(1-methylene-3-oxo-2-isoindolyl)acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(1-methylidene-3-oxoisoindol-2-yl)acetate Traditional Name: 2-(1-keto-3-methylene-isoindolin-2-yl)acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H14N2O3S MolecularWeight: 350.39106

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CC(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H14N2O3S/c1-12-13-6-2-3-7-14(13)19(23)21(12)10-18(22)24-11-17-20-15-8-4-5-9-16(15)25-17/h2-9H,1,10-11H2