1-decan-2-yl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-decan-2-yl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(1-methylnonyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-decan-2-yl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-decan-2-yl-4-oxoquinoline-3-carboxylic acid Traditional Name: 4-keto-1-(1-methylnonyl)quinoline-3-carboxylic acid Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C)N1C=C(C(=O)C2=CC=CC=C21)C(=O)O

Isomeric SMILES

CCCCCCCCC(C)N1C=C(C(=O)C2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C20H27NO3/c1-3-4-5-6-7-8-11-15(2)21-14-17(20(23)24)19(22)16-12-9-10-13-18(16)21/h9-10,12-15H,3-8,11H2,1-2H3,(H,23,24)