quinolin-4-ylmethyl 7-oxidanylideneoctanoate

Systemtic Name: quinolin-4-ylmethyl 7-oxidanylideneoctanoate Openeye Name: 4-quinolylmethyl 7-oxooctanoate CAS Name: 7-oxooctanoic acid 4-quinolinylmethyl ester IUPAC Name: quinolin-4-ylmethyl 7-oxooctanoate Traditional Name: 7-ketocaprylic acid 4-quinolylmethyl ester Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCCC(=O)OCC1=CC=NC2=CC=CC=C12

Isomeric SMILES

CC(=O)CCCCCC(=O)OCC1=CC=NC2=CC=CC=C12

InChI

InChI=1S/C18H21NO3/c1-14(20)7-3-2-4-10-18(21)22-13-15-11-12-19-17-9-6-5-8-16(15)17/h5-6,8-9,11-12H,2-4,7,10,13H2,1H3