methyl 5-oxidanylidene-5-[3-(quinolin-2-ylmethoxy)phenyl]pentanoate

Systemtic Name: methyl 5-oxidanylidene-5-[3-(quinolin-2-ylmethoxy)phenyl]pentanoate Openeye Name: methyl 5-oxo-5-[3-(2-quinolylmethoxy)phenyl]pentanoate CAS Name: 5-oxo-5-[3-(2-quinolinylmethoxy)phenyl]pentanoic acid methyl ester IUPAC Name: methyl 5-oxo-5-[3-(quinolin-2-ylmethoxy)phenyl]pentanoate Traditional Name: 5-keto-5-[3-(2-quinolylmethoxy)phenyl]valeric acid methyl ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)C1=CC(=CC=C1)OCC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

COC(=O)CCCC(=O)C1=CC(=CC=C1)OCC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H21NO4/c1-26-22(25)11-5-10-21(24)17-7-4-8-19(14-17)27-15-18-13-12-16-6-2-3-9-20(16)23-18/h2-4,6-9,12-14H,5,10-11,15H2,1H3