1-[(5-chloranyl-2-methoxy-phenyl)-(3-methylpyridin-4-yl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-(3-methylpyridin-4-yl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)-(3-methyl-4-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-(3-methylpyridin-4-yl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-chloro-2-methoxy-phenyl)-(3-methyl-4-pyridyl)methyl]proline Formula: C19H21ClN2O3 MolecularWeight: 360.83464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)C(C2=C(C=CC(=C2)Cl)OC)N3CCCC3C(=O)O

Isomeric SMILES

CC1=C(C=CN=C1)C(C2=C(C=CC(=C2)Cl)OC)N3CCCC3C(=O)O

InChI

InChI=1S/C19H21ClN2O3/c1-12-11-21-8-7-14(12)18(22-9-3-4-16(22)19(23)24)15-10-13(20)5-6-17(15)25-2/h5-8,10-11,16,18H,3-4,9H2,1-2H3,(H,23,24)