[1-(phenylmethyl)pyrrolidin-3-yl] hexanoate

Systemtic Name: [1-(phenylmethyl)pyrrolidin-3-yl] hexanoate Openeye Name: (1-benzylpyrrolidin-3-yl) hexanoate CAS Name: hexanoic acid [1-(phenylmethyl)-3-pyrrolidinyl] ester IUPAC Name: (1-benzylpyrrolidin-3-yl) hexanoate Traditional Name: hexanoic acid (1-benzylpyrrolidin-3-yl) ester Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1CCN(C1)CC2=CC=CC=C2

Isomeric SMILES

CCCCCC(=O)OC1CCN(C1)CC2=CC=CC=C2

InChI

InChI=1S/C17H25NO2/c1-2-3-5-10-17(19)20-16-11-12-18(14-16)13-15-8-6-4-7-9-15/h4,6-9,16H,2-3,5,10-14H2,1H3