[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl] 3-(2-methoxyphenyl)prop-2-enoate

Systemtic Name: [2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl] 3-(2-methoxyphenyl)prop-2-enoate Openeye Name: [2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl] 3-(2-methoxyphenyl)prop-2-enoate CAS Name: 3-(2-methoxyphenyl)-2-propenoic acid [2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester IUPAC Name: [2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 3-(2-methoxyphenyl)prop-2-enoate Traditional Name: 3-(2-methoxyphenyl)acrylic acid [2-(2,5-dimethyl-1-piperonyl-pyrrol-3-yl)-2-keto-ethyl] ester Formula: C26H25NO6 MolecularWeight: 447.4798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)COC(=O)C=CC4=CC=CC=C4OC

Isomeric SMILES

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)COC(=O)C=CC4=CC=CC=C4OC

InChI

InChI=1S/C26H25NO6/c1-17-12-21(18(2)27(17)14-19-8-10-24-25(13-19)33-16-32-24)22(28)15-31-26(29)11-9-20-6-4-5-7-23(20)30-3/h4-13H,14-16H2,1-3H3