1-[(5-methylpyridin-2-yl)-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-methylpyridin-2-yl)-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-methyl-2-pyridyl)-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-methyl-2-pyridinyl)-(3-phenoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-methylpyridin-2-yl)-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-methyl-2-pyridyl)-(3-phenoxyphenyl)methyl]proline Formula: C24H24N2O3 MolecularWeight: 388.45896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)N4CCCC4C(=O)O

Isomeric SMILES

CC1=CN=C(C=C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)N4CCCC4C(=O)O

InChI

InChI=1S/C24H24N2O3/c1-17-12-13-21(25-16-17)23(26-14-6-11-22(26)24(27)28)18-7-5-10-20(15-18)29-19-8-3-2-4-9-19/h2-5,7-10,12-13,15-16,22-23H,6,11,14H2,1H3,(H,27,28)