1-[(5-chloranyl-2-methoxy-phenyl)-pyridin-4-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-pyridin-4-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)-(4-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-methoxyphenyl)-pyridin-4-ylmethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-pyridin-4-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-chloro-2-methoxy-phenyl)-(4-pyridyl)methyl]proline Formula: C18H19ClN2O3 MolecularWeight: 346.80806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(C2=CC=NC=C2)N3CCCC3C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(C2=CC=NC=C2)N3CCCC3C(=O)O

InChI

InChI=1S/C18H19ClN2O3/c1-24-16-5-4-13(19)11-14(16)17(12-6-8-20-9-7-12)21-10-2-3-15(21)18(22)23/h4-9,11,15,17H,2-3,10H2,1H3,(H,22,23)