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

Systemtic Name: ethyl 4-[(E)-3-(4-methoxy-3-propoxy-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(E)-3-(4-methoxy-3-propoxy-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(E)-3-(4-methoxy-3-propoxyphenyl)-1-oxoprop-2-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-3-(4-methoxy-3-propoxyphenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(E)-3-(4-methoxy-3-propoxy-phenyl)acryloyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)C=CC(=O)C2=C(NC(=C2C)C(=O)OCC)C)OC

Isomeric SMILES

CCCOC1=C(C=CC(=C1)/C=C/C(=O)C2=C(NC(=C2C)C(=O)OCC)C)OC

InChI

InChI=1S/C22H27NO5/c1-6-12-28-19-13-16(9-11-18(19)26-5)8-10-17(24)20-14(3)21(23-15(20)4)22(25)27-7-2/h8-11,13,23H,6-7,12H2,1-5H3/b10-8+