ethyl 3-(2-cyclopropylcarbonylimino-4,7-dimethoxy-1,3-benzothiazol-3-yl)propanoate

Systemtic Name: ethyl 3-(2-cyclopropylcarbonylimino-4,7-dimethoxy-1,3-benzothiazol-3-yl)propanoate Openeye Name: ethyl 3-[2-(cyclopropanecarbonylimino)-4,7-dimethoxy-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[cyclopropyl(oxo)methyl]imino-4,7-dimethoxy-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(cyclopropanecarbonylimino)-4,7-dimethoxy-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(cyclopropanecarbonylimino)-4,7-dimethoxy-1,3-benzothiazol-3-yl]propionic acid ethyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(C=CC(=C2SC1=NC(=O)C3CC3)OC)OC

Isomeric SMILES

CCOC(=O)CCN1C2=C(C=CC(=C2SC1=NC(=O)C3CC3)OC)OC

InChI

InChI=1S/C18H22N2O5S/c1-4-25-14(21)9-10-20-15-12(23-2)7-8-13(24-3)16(15)26-18(20)19-17(22)11-5-6-11/h7-8,11H,4-6,9-10H2,1-3H3