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

Systemtic Name: 4-[(E)-3-(4-methoxy-3-propoxy-phenyl)prop-2-enoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: 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-carboxylate IUPAC Name: 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-carboxylate Formula: C20H22NO5- MolecularWeight: 356.39238

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)C=CC(=O)C2=C(NC(=C2C)C(=O)[O-])C)OC

Isomeric SMILES

CCCOC1=C(C=CC(=C1)/C=C/C(=O)C2=C(NC(=C2C)C(=O)[O-])C)OC

InChI

InChI=1S/C20H23NO5/c1-5-10-26-17-11-14(7-9-16(17)25-4)6-8-15(22)18-12(2)19(20(23)24)21-13(18)3/h6-9,11,21H,5,10H2,1-4H3,(H,23,24)/p-1/b8-6+