ethyl 3-(6-chloranyl-2-cyclopropylcarbonylimino-1,3-benzothiazol-3-yl)propanoate

Systemtic Name: ethyl 3-(6-chloranyl-2-cyclopropylcarbonylimino-1,3-benzothiazol-3-yl)propanoate Openeye Name: ethyl 3-[6-chloro-2-(cyclopropanecarbonylimino)-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[6-chloro-2-[cyclopropyl(oxo)methyl]imino-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[6-chloro-2-(cyclopropanecarbonylimino)-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[6-chloro-2-(cyclopropanecarbonylimino)-1,3-benzothiazol-3-yl]propionic acid ethyl ester Formula: C16H17ClN2O3S MolecularWeight: 352.83578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)C3CC3

Isomeric SMILES

CCOC(=O)CCN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)C3CC3

InChI

InChI=1S/C16H17ClN2O3S/c1-2-22-14(20)7-8-19-12-6-5-11(17)9-13(12)23-16(19)18-15(21)10-3-4-10/h5-6,9-10H,2-4,7-8H2,1H3