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

Systemtic Name: ethyl 5-[2-[(E)-3-(4-cyanophenyl)prop-2-enoyl]oxyethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-[(E)-3-(4-cyanophenyl)prop-2-enoyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[(E)-3-(4-cyanophenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[(E)-3-(4-cyanophenyl)prop-2-enoyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[(E)-3-(4-cyanophenyl)acryloyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)COC(=O)C=CC2=CC=C(C=C2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)COC(=O)/C=C/C2=CC=C(C=C2)C#N)C

InChI

InChI=1S/C21H20N2O5/c1-4-27-21(26)19-13(2)20(23-14(19)3)17(24)12-28-18(25)10-9-15-5-7-16(11-22)8-6-15/h5-10,23H,4,12H2,1-3H3/b10-9+