methyl 4-(1,3-benzodioxol-5-ylmethylidene)-1-(3-methoxypropyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(1,3-benzodioxol-5-ylmethylidene)-1-(3-methoxypropyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-ylmethylene)-1-(3-methoxypropyl)-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethylidene)-1-(3-methoxypropyl)-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-ylmethylidene)-1-(3-methoxypropyl)-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: 5-keto-1-(3-methoxypropyl)-2-methyl-4-piperonylidene-2-pyrroline-3-carboxylic acid methyl ester Formula: C19H21NO6 MolecularWeight: 359.37314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC3=C(C=C2)OCO3)C(=O)N1CCCOC)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC2=CC3=C(C=C2)OCO3)C(=O)N1CCCOC)C(=O)OC

InChI

InChI=1S/C19H21NO6/c1-12-17(19(22)24-3)14(18(21)20(12)7-4-8-23-2)9-13-5-6-15-16(10-13)26-11-25-15/h5-6,9-10H,4,7-8,11H2,1-3H3