heptyl 2-(2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: heptyl 2-(2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate Openeye Name: heptyl 2-(2-oxo-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(2-oxo-1,3-benzothiazol-3-yl)acetic acid heptyl ester IUPAC Name: heptyl 2-(2-oxo-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(2-keto-1,3-benzothiazol-3-yl)acetic acid heptyl ester Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)CN1C2=CC=CC=C2SC1=O

Isomeric SMILES

CCCCCCCOC(=O)CN1C2=CC=CC=C2SC1=O

InChI

InChI=1S/C16H21NO3S/c1-2-3-4-5-8-11-20-15(18)12-17-13-9-6-7-10-14(13)21-16(17)19/h6-7,9-10H,2-5,8,11-12H2,1H3