ethyl 3-(1,3-benzodioxol-5-yl)-5-(4-propoxyphenyl)-3,4-dihydro-2H-pyrrole-4-carboxylate

Systemtic Name: ethyl 3-(1,3-benzodioxol-5-yl)-5-(4-propoxyphenyl)-3,4-dihydro-2H-pyrrole-4-carboxylate Openeye Name: ethyl 3-(1,3-benzodioxol-5-yl)-5-(4-propoxyphenyl)-3,4-dihydro-2H-pyrrole-4-carboxylate CAS Name: 3-(1,3-benzodioxol-5-yl)-5-(4-propoxyphenyl)-3,4-dihydro-2H-pyrrole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzodioxol-5-yl)-5-(4-propoxyphenyl)-3,4-dihydro-2H-pyrrole-4-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-(4-propoxyphenyl)-1-pyrroline-3-carboxylic acid ethyl ester Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NCC(C2C(=O)OCC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NCC(C2C(=O)OCC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H25NO5/c1-3-11-27-17-8-5-15(6-9-17)22-21(23(25)26-4-2)18(13-24-22)16-7-10-19-20(12-16)29-14-28-19/h5-10,12,18,21H,3-4,11,13-14H2,1-2H3