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

Systemtic Name: 1-[(3-chloranyl-4-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-chloro-4-methoxy-phenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-chloro-4-methoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-chloro-4-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(3-chloro-4-methoxy-benzyl)proline Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCCC2C(=O)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCCC2C(=O)O)Cl

InChI

InChI=1S/C13H16ClNO3/c1-18-12-5-4-9(7-10(12)14)8-15-6-2-3-11(15)13(16)17/h4-5,7,11H,2-3,6,8H2,1H3,(H,16,17)