methyl 3-(2-cyclopropylcarbonylimino-6-ethoxy-1,3-benzothiazol-3-yl)propanoate

Systemtic Name: methyl 3-(2-cyclopropylcarbonylimino-6-ethoxy-1,3-benzothiazol-3-yl)propanoate Openeye Name: methyl 3-[2-(cyclopropanecarbonylimino)-6-ethoxy-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[cyclopropyl(oxo)methyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(cyclopropanecarbonylimino)-6-ethoxy-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(cyclopropanecarbonylimino)-6-ethoxy-1,3-benzothiazol-3-yl]propionic acid methyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3CC3)S2)CCC(=O)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3CC3)S2)CCC(=O)OC

InChI

InChI=1S/C17H20N2O4S/c1-3-23-12-6-7-13-14(10-12)24-17(18-16(21)11-4-5-11)19(13)9-8-15(20)22-2/h6-7,10-11H,3-5,8-9H2,1-2H3