ethyl 4-[(E)-3-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[(E)-3-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(E)-3-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(E)-3-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)-1-oxoprop-2-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-3-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(E)-3-(5-ethoxy-2-methyl-coumaran-6-yl)acryloyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=CC(=O)C3=C(NC(=C3C)C(=O)OCC)C)OC(C2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1/C=C/C(=O)C3=C(NC(=C3C)C(=O)OCC)C)OC(C2)C

InChI

InChI=1S/C23H27NO5/c1-6-27-19-12-17-10-13(3)29-20(17)11-16(19)8-9-18(25)21-14(4)22(24-15(21)5)23(26)28-7-2/h8-9,11-13,24H,6-7,10H2,1-5H3/b9-8+