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

Systemtic Name: 1-[(3,4-diethoxyphenyl)-(3-methylphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,4-diethoxyphenyl)-(m-tolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,4-diethoxyphenyl)-(3-methylphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,4-diethoxyphenyl)-(3-methylphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3,4-diethoxyphenyl)-(m-tolyl)methyl]proline Formula: C23H29NO4 MolecularWeight: 383.48066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CC=CC(=C2)C)N3CCCC3C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC=CC(=C2)C)N3CCCC3C(=O)O)OCC

InChI

InChI=1S/C23H29NO4/c1-4-27-20-12-11-18(15-21(20)28-5-2)22(17-9-6-8-16(3)14-17)24-13-7-10-19(24)23(25)26/h6,8-9,11-12,14-15,19,22H,4-5,7,10,13H2,1-3H3,(H,25,26)