ethyl 5-[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enoxy]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[3-(1,3-benzodioxol-5-yl)acryloyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H21NO7 MolecularWeight: 399.39394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)COC(=O)C=CC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)COC(=O)C=CC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C21H21NO7/c1-4-26-21(25)19-12(2)20(22-13(19)3)15(23)10-27-18(24)8-6-14-5-7-16-17(9-14)29-11-28-16/h5-9,22H,4,10-11H2,1-3H3