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

Systemtic Name: 1-[(3-methoxy-4-phenethyloxy-phenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-methoxy-4-phenethyloxy-phenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methoxy-4-phenethyloxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-methoxy-4-phenethyloxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(3-methoxy-4-phenethyloxy-benzyl)proline Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CCCC2C(=O)O)OCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CCCC2C(=O)O)OCCC3=CC=CC=C3

InChI

InChI=1S/C21H25NO4/c1-25-20-14-17(15-22-12-5-8-18(22)21(23)24)9-10-19(20)26-13-11-16-6-3-2-4-7-16/h2-4,6-7,9-10,14,18H,5,8,11-13,15H2,1H3,(H,23,24)