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

Systemtic Name: ethyl (3S,4R)-3-(1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-3,4-dihydro-2H-pyrrole-4-carboxylate Openeye Name: ethyl (3S,4R)-3-(1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-3,4-dihydro-2H-pyrrole-4-carboxylate CAS Name: (3S,4R)-3-(1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-3,4-dihydro-2H-pyrrole-4-carboxylic acid ethyl ester IUPAC Name: ethyl (3S,4R)-3-(1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-3,4-dihydro-2H-pyrrole-4-carboxylate Traditional Name: (3R,4S)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-pyrroline-3-carboxylic acid ethyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CN=C1C2=CC=C(C=C2)OC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](CN=C1C2=CC=C(C=C2)OC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21NO5/c1-3-25-21(23)19-16(14-6-9-17-18(10-14)27-12-26-17)11-22-20(19)13-4-7-15(24-2)8-5-13/h4-10,16,19H,3,11-12H2,1-2H3/t16-,19-/m1/s1