methyl 2-[2-(1,3-benzodioxol-5-ylcarbonylimino)-6-methoxy-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(1,3-benzodioxol-5-ylcarbonylimino)-6-methoxy-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(1,3-benzodioxole-5-carbonylimino)-6-methoxy-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[1,3-benzodioxol-5-yl(oxo)methyl]imino-6-methoxy-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(1,3-benzodioxole-5-carbonylimino)-6-methoxy-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(6-methoxy-2-piperonyloylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C19H16N2O6S MolecularWeight: 400.40514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(C=C3)OCO4)S2)CC(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(C=C3)OCO4)S2)CC(=O)OC

InChI

InChI=1S/C19H16N2O6S/c1-24-12-4-5-13-16(8-12)28-19(21(13)9-17(22)25-2)20-18(23)11-3-6-14-15(7-11)27-10-26-14/h3-8H,9-10H2,1-2H3