1-[(5-chloranyl-2-ethoxy-phenyl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2-ethoxy-phenyl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-chloro-2-ethoxy-phenyl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-ethoxyphenyl)-(2-methoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2-ethoxyphenyl)-(2-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-chloro-2-ethoxy-phenyl)-(2-methoxyphenyl)methyl]proline Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C(C2=CC=CC=C2OC)N3CCCC3C(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C(C2=CC=CC=C2OC)N3CCCC3C(=O)O

InChI

InChI=1S/C21H24ClNO4/c1-3-27-19-11-10-14(22)13-16(19)20(15-7-4-5-9-18(15)26-2)23-12-6-8-17(23)21(24)25/h4-5,7,9-11,13,17,20H,3,6,8,12H2,1-2H3,(H,24,25)