methyl 3-quinolin-2-ylcarbonylheptanoate

Systemtic Name: methyl 3-quinolin-2-ylcarbonylheptanoate Openeye Name: methyl 3-(quinoline-2-carbonyl)heptanoate CAS Name: 3-[oxo(2-quinolinyl)methyl]heptanoic acid methyl ester IUPAC Name: methyl 3-(quinoline-2-carbonyl)heptanoate Traditional Name: 3-quinaldoylenanthic acid methyl ester Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)OC)C(=O)C1=NC2=CC=CC=C2C=C1

Isomeric SMILES

CCCCC(CC(=O)OC)C(=O)C1=NC2=CC=CC=C2C=C1

InChI

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