4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-[3-(propylamino)propyl]pyrrolidine-3-carboxylate

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-[3-(propylamino)propyl]pyrrolidine-3-carboxylate Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-[3-(propylamino)propyl]pyrrolidine-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-[3-(propylamino)propyl]-3-pyrrolidinecarboxylate IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-[3-(propylamino)propyl]pyrrolidine-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-[3-(propylamino)propyl]pyrrolidine-3-carboxylate Formula: C25H31N2O5- MolecularWeight: 439.52404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNCCCN1CC(C(C1C2=CC=C(C=C2)OC)C(=O)[O-])C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCNCCCN1CC(C(C1C2=CC=C(C=C2)OC)C(=O)[O-])C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H32N2O5/c1-3-11-26-12-4-13-27-15-20(18-7-10-21-22(14-18)32-16-31-21)23(25(28)29)24(27)17-5-8-19(30-2)9-6-17/h5-10,14,20,23-24,26H,3-4,11-13,15-16H2,1-2H3,(H,28,29)/p-1