(2-phenylpyrrolidin-3-yl) 2-(pyridin-3-ylmethyl)hexanoate

Systemtic Name: (2-phenylpyrrolidin-3-yl) 2-(pyridin-3-ylmethyl)hexanoate Openeye Name: (2-phenylpyrrolidin-3-yl) 2-(3-pyridylmethyl)hexanoate CAS Name: 2-(3-pyridinylmethyl)hexanoic acid (2-phenyl-3-pyrrolidinyl) ester IUPAC Name: (2-phenylpyrrolidin-3-yl) 2-(pyridin-3-ylmethyl)hexanoate Traditional Name: 2-(3-pyridylmethyl)hexanoic acid (2-phenylpyrrolidin-3-yl) ester Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=CN=CC=C1)C(=O)OC2CCNC2C3=CC=CC=C3

Isomeric SMILES

CCCCC(CC1=CN=CC=C1)C(=O)OC2CCNC2C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2/c1-2-3-9-19(15-17-8-7-13-23-16-17)22(25)26-20-12-14-24-21(20)18-10-5-4-6-11-18/h4-8,10-11,13,16,19-21,24H,2-3,9,12,14-15H2,1H3