(2-oxidanylidene-1-phenyl-ethyl) 2-cyclopentyl-2-[4-(quinolin-2-ylmethoxy)phenyl]ethanoate

Systemtic Name: (2-oxidanylidene-1-phenyl-ethyl) 2-cyclopentyl-2-[4-(quinolin-2-ylmethoxy)phenyl]ethanoate Openeye Name: (2-oxo-1-phenyl-ethyl) 2-cyclopentyl-2-[4-(2-quinolylmethoxy)phenyl]acetate CAS Name: 2-cyclopentyl-2-[4-(2-quinolinylmethoxy)phenyl]acetic acid (2-oxo-1-phenylethyl) ester IUPAC Name: (2-oxo-1-phenylethyl) 2-cyclopentyl-2-[4-(quinolin-2-ylmethoxy)phenyl]acetate Traditional Name: 2-cyclopentyl-2-[4-(2-quinolylmethoxy)phenyl]acetic acid (2-keto-1-phenyl-ethyl) ester Formula: C31H29NO4 MolecularWeight: 479.56626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)C(=O)OC(C=O)C5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)C(C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)C(=O)OC(C=O)C5=CC=CC=C5

InChI

InChI=1S/C31H29NO4/c33-20-29(23-9-2-1-3-10-23)36-31(34)30(24-11-4-5-12-24)25-15-18-27(19-16-25)35-21-26-17-14-22-8-6-7-13-28(22)32-26/h1-3,6-10,13-20,24,29-30H,4-5,11-12,21H2