methyl 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-5-(furan-2-yl)pyrrole-2-carboxylate

Systemtic Name: methyl 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-5-(furan-2-yl)pyrrole-2-carboxylate Openeye Name: methyl 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]-5-(2-furyl)pyrrole-2-carboxylate CAS Name: 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-5-(2-furanyl)-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-5-(furan-2-yl)pyrrole-2-carboxylate Traditional Name: 5-(2-furyl)-1-[2-keto-2-(piperonylamino)ethyl]pyrrole-2-carboxylic acid methyl ester Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(N1CC(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CO4

Isomeric SMILES

COC(=O)C1=CC=C(N1CC(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CO4

InChI

InChI=1S/C20H18N2O6/c1-25-20(24)15-6-5-14(16-3-2-8-26-16)22(15)11-19(23)21-10-13-4-7-17-18(9-13)28-12-27-17/h2-9H,10-12H2,1H3,(H,21,23)