1-[(4-octoxyphenyl)methyl]pyrrolidine-3-carboxylic acid

Systemtic Name: 1-[(4-octoxyphenyl)methyl]pyrrolidine-3-carboxylic acid Openeye Name: 1-[(4-octoxyphenyl)methyl]pyrrolidine-3-carboxylic acid CAS Name: 1-[(4-octoxyphenyl)methyl]-3-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-octoxyphenyl)methyl]pyrrolidine-3-carboxylic acid Traditional Name: 1-(4-octoxybenzyl)pyrrolidine-3-carboxylic acid Formula: C20H31NO3 MolecularWeight: 333.46504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)CN2CCC(C2)C(=O)O

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)CN2CCC(C2)C(=O)O

InChI

InChI=1S/C20H31NO3/c1-2-3-4-5-6-7-14-24-19-10-8-17(9-11-19)15-21-13-12-18(16-21)20(22)23/h8-11,18H,2-7,12-16H2,1H3,(H,22,23)