ethyl 4-[(E)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[(E)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(E)-3-(3-ethoxy-2-propoxy-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(E)-3-(3-ethoxy-2-propoxyphenyl)-1-oxoprop-2-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-3-(3-ethoxy-2-propoxyphenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(E)-3-(3-ethoxy-2-propoxy-phenyl)acryloyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC=C1OCC)C=CC(=O)C2=C(NC(=C2C)C(=O)OCC)C

Isomeric SMILES

CCCOC1=C(C=CC=C1OCC)/C=C/C(=O)C2=C(NC(=C2C)C(=O)OCC)C

InChI

InChI=1S/C23H29NO5/c1-6-14-29-22-17(10-9-11-19(22)27-7-2)12-13-18(25)20-15(4)21(24-16(20)5)23(26)28-8-3/h9-13,24H,6-8,14H2,1-5H3/b13-12+