1-[(3,4-diethoxyphenyl)-(4-phenylphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3,4-diethoxyphenyl)-(4-phenylphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,4-diethoxyphenyl)-(4-phenylphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,4-diethoxyphenyl)-(4-phenylphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,4-diethoxyphenyl)-(4-phenylphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3,4-diethoxyphenyl)-(4-phenylphenyl)methyl]proline Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CC=C(C=C2)C3=CC=CC=C3)N4CCCC4C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC=C(C=C2)C3=CC=CC=C3)N4CCCC4C(=O)O)OCC

InChI

InChI=1S/C28H31NO4/c1-3-32-25-17-16-23(19-26(25)33-4-2)27(29-18-8-11-24(29)28(30)31)22-14-12-21(13-15-22)20-9-6-5-7-10-20/h5-7,9-10,12-17,19,24,27H,3-4,8,11,18H2,1-2H3,(H,30,31)