4-(1,3-benzodioxol-5-yl)-2-pentyl-1-[2-[propyl(propylsulfonyl)amino]ethyl]pyrrolidine-3-carboxylate

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-pentyl-1-[2-[propyl(propylsulfonyl)amino]ethyl]pyrrolidine-3-carboxylate Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-pentyl-1-[2-[propyl(propylsulfonyl)amino]ethyl]pyrrolidine-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-2-pentyl-1-[2-[propyl(propylsulfonyl)amino]ethyl]-3-pyrrolidinecarboxylate IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-pentyl-1-[2-[propyl(propylsulfonyl)amino]ethyl]pyrrolidine-3-carboxylate Traditional Name: 2-amyl-4-(1,3-benzodioxol-5-yl)-1-[2-[propyl(propylsulfonyl)amino]ethyl]pyrrolidine-3-carboxylate Formula: C25H39N2O6S- MolecularWeight: 495.65196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(C(CN1CCN(CCC)S(=O)(=O)CCC)C2=CC3=C(C=C2)OCO3)C(=O)[O-]

Isomeric SMILES

CCCCCC1C(C(CN1CCN(CCC)S(=O)(=O)CCC)C2=CC3=C(C=C2)OCO3)C(=O)[O-]

InChI

InChI=1S/C25H40N2O6S/c1-4-7-8-9-21-24(25(28)29)20(19-10-11-22-23(16-19)33-18-32-22)17-26(21)13-14-27(12-5-2)34(30,31)15-6-3/h10-11,16,20-21,24H,4-9,12-15,17-18H2,1-3H3,(H,28,29)/p-1