cyclohexyl 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: cyclohexyl 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate Openeye Name: cyclohexyl 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(4-chloro-2-keto-1,3-benzothiazol-3-yl)acetic acid cyclohexyl ester Formula: C15H16ClNO3S MolecularWeight: 325.81044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)CN2C3=C(C=CC=C3Cl)SC2=O

Isomeric SMILES

C1CCC(CC1)OC(=O)CN2C3=C(C=CC=C3Cl)SC2=O

InChI

InChI=1S/C15H16ClNO3S/c16-11-7-4-8-12-14(11)17(15(19)21-12)9-13(18)20-10-5-2-1-3-6-10/h4,7-8,10H,1-3,5-6,9H2