ethyl 5-[2-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]oxyethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[2-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]oxyethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[(E)-3-(4-ethoxyphenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[(E)-3-p-phenetylacryloyl]oxyacetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)OCC(=O)C2=C(C(=C(N2)C)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)OCC(=O)C2=C(C(=C(N2)C)C(=O)OCC)C

InChI

InChI=1S/C22H25NO6/c1-5-27-17-10-7-16(8-11-17)9-12-19(25)29-13-18(24)21-14(3)20(15(4)23-21)22(26)28-6-2/h7-12,23H,5-6,13H2,1-4H3/b12-9+