1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-isopentyloxy-3-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(4-isoamoxy-3-methoxy-benzyl)proline Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)CN2CCCC2C(=O)O)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)CN2CCCC2C(=O)O)OC

InChI

InChI=1S/C18H27NO4/c1-13(2)8-10-23-16-7-6-14(11-17(16)22-3)12-19-9-4-5-15(19)18(20)21/h6-7,11,13,15H,4-5,8-10,12H2,1-3H3,(H,20,21)