(2-oxidanyl-1-phenethyl-pyrrolidin-3-yl) benzoate

Systemtic Name: (2-oxidanyl-1-phenethyl-pyrrolidin-3-yl) benzoate Openeye Name: (2-hydroxy-1-phenethyl-pyrrolidin-3-yl) benzoate CAS Name: benzoic acid (2-hydroxy-1-phenethyl-3-pyrrolidinyl) ester IUPAC Name: (2-hydroxy-1-phenethylpyrrolidin-3-yl) benzoate Traditional Name: benzoic acid (2-hydroxy-1-phenethyl-pyrrolidin-3-yl) ester Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1OC(=O)C2=CC=CC=C2)O)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(C(C1OC(=O)C2=CC=CC=C2)O)CCC3=CC=CC=C3

InChI

InChI=1S/C19H21NO3/c21-18-17(23-19(22)16-9-5-2-6-10-16)12-14-20(18)13-11-15-7-3-1-4-8-15/h1-10,17-18,21H,11-14H2