methyl 3-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethoxy]benzoate CAS Name: 3-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethoxy]benzoate Traditional Name: 3-[2-keto-2-(piperonylamino)ethoxy]benzoic acid methyl ester Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OCC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OCC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H17NO6/c1-22-18(21)13-3-2-4-14(8-13)23-10-17(20)19-9-12-5-6-15-16(7-12)25-11-24-15/h2-8H,9-11H2,1H3,(H,19,20)