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

Systemtic Name: 1-[(3-methoxy-4-phenylmethoxy-phenyl)-phenyl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)-phenyl-methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)-phenylmethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)-phenylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-benzoxy-3-methoxy-phenyl)-phenyl-methyl]proline Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C2=CC=CC=C2)N3CCCC3C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(C2=CC=CC=C2)N3CCCC3C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H27NO4/c1-30-24-17-21(14-15-23(24)31-18-19-9-4-2-5-10-19)25(20-11-6-3-7-12-20)27-16-8-13-22(27)26(28)29/h2-7,9-12,14-15,17,22,25H,8,13,16,18H2,1H3,(H,28,29)