4-(1,3-benzodioxol-5-yl)-2-pentyl-pyrrolidine-3-carboxylic acid

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-pentyl-pyrrolidine-3-carboxylic acid Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-pentyl-pyrrolidine-3-carboxylic acid CAS Name: 4-(1,3-benzodioxol-5-yl)-2-pentyl-3-pyrrolidinecarboxylic acid IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-pentylpyrrolidine-3-carboxylic acid Traditional Name: 2-amyl-4-(1,3-benzodioxol-5-yl)pyrrolidine-3-carboxylic acid Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(C(CN1)C2=CC3=C(C=C2)OCO3)C(=O)O

Isomeric SMILES

CCCCCC1C(C(CN1)C2=CC3=C(C=C2)OCO3)C(=O)O

InChI

InChI=1S/C17H23NO4/c1-2-3-4-5-13-16(17(19)20)12(9-18-13)11-6-7-14-15(8-11)22-10-21-14/h6-8,12-13,16,18H,2-5,9-10H2,1H3,(H,19,20)