1-[(4-butoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(4-butoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-butoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-butoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-butoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(4-butoxybenzyl)proline Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CN2CCCC2C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CN2CCCC2C(=O)O

InChI

InChI=1S/C16H23NO3/c1-2-3-11-20-14-8-6-13(7-9-14)12-17-10-4-5-15(17)16(18)19/h6-9,15H,2-5,10-12H2,1H3,(H,18,19)