ethyl 1-(3-methylbutyl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-(3-methylbutyl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-isopentyl-4-oxo-quinoline-3-carboxylate CAS Name: 1-(3-methylbutyl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-methylbutyl)-4-oxoquinoline-3-carboxylate Traditional Name: 1-isoamyl-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC=CC=C2C1=O)CCC(C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC=CC=C2C1=O)CCC(C)C

InChI

InChI=1S/C17H21NO3/c1-4-21-17(20)14-11-18(10-9-12(2)3)15-8-6-5-7-13(15)16(14)19/h5-8,11-12H,4,9-10H2,1-3H3