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

Systemtic Name: 1-[(3,4-diethoxyphenyl)-(2-methylphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3,4-diethoxyphenyl)-(o-tolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3,4-diethoxyphenyl)-(2-methylphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3,4-diethoxyphenyl)-(2-methylphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(3,4-diethoxyphenyl)-(o-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=C2C)N3CCCC3C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC=CC=C2C)N3CCCC3C(=O)O)OCC

InChI

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