(1-oxidanylidene-1-pyrrolidin-1-yl-octan-2-yl) 2-phenylbutanoate

Systemtic Name: (1-oxidanylidene-1-pyrrolidin-1-yl-octan-2-yl) 2-phenylbutanoate Openeye Name: 1-(pyrrolidine-1-carbonyl)heptyl 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid [1-oxo-1-(1-pyrrolidinyl)octan-2-yl] ester IUPAC Name: (1-oxo-1-pyrrolidin-1-yloctan-2-yl) 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid 1-(pyrrolidine-1-carbonyl)heptyl ester Formula: C22H33NO3 MolecularWeight: 359.50232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)N1CCCC1)OC(=O)C(CC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC(C(=O)N1CCCC1)OC(=O)C(CC)C2=CC=CC=C2

InChI

InChI=1S/C22H33NO3/c1-3-5-6-10-15-20(21(24)23-16-11-12-17-23)26-22(25)19(4-2)18-13-8-7-9-14-18/h7-9,13-14,19-20H,3-6,10-12,15-17H2,1-2H3