4-(4-methoxy-3-phenylmethoxy-phenyl)-3-methyl-1-(phenylmethyl)pyrrolidine-3-carboxylic acid

Systemtic Name: 4-(4-methoxy-3-phenylmethoxy-phenyl)-3-methyl-1-(phenylmethyl)pyrrolidine-3-carboxylic acid Openeye Name: 1-benzyl-4-(3-benzyloxy-4-methoxy-phenyl)-3-methyl-pyrrolidine-3-carboxylic acid CAS Name: 4-(4-methoxy-3-phenylmethoxyphenyl)-3-methyl-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid IUPAC Name: 1-benzyl-4-(4-methoxy-3-phenylmethoxyphenyl)-3-methylpyrrolidine-3-carboxylic acid Traditional Name: 4-(3-benzoxy-4-methoxy-phenyl)-1-benzyl-3-methyl-pyrrolidine-3-carboxylic acid Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC1C2=CC(=C(C=C2)OC)OCC3=CC=CC=C3)CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1(CN(CC1C2=CC(=C(C=C2)OC)OCC3=CC=CC=C3)CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H29NO4/c1-27(26(29)30)19-28(16-20-9-5-3-6-10-20)17-23(27)22-13-14-24(31-2)25(15-22)32-18-21-11-7-4-8-12-21/h3-15,23H,16-19H2,1-2H3,(H,29,30)