methyl 3-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethoxy]benzoate CAS Name: 3-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethoxy]benzoate Traditional Name: 3-[2-(2,5-dimethyl-1-piperonyl-pyrrol-3-yl)-2-keto-ethoxy]benzoic acid methyl ester Formula: C24H23NO6 MolecularWeight: 421.44252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)COC4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)COC4=CC=CC(=C4)C(=O)OC

InChI

InChI=1S/C24H23NO6/c1-15-9-20(21(26)13-29-19-6-4-5-18(11-19)24(27)28-3)16(2)25(15)12-17-7-8-22-23(10-17)31-14-30-22/h4-11H,12-14H2,1-3H3