3-methylbutyl 1-(3-methylbutyl)-2-oxidanylidene-quinoline-4-carboxylate

Systemtic Name: 3-methylbutyl 1-(3-methylbutyl)-2-oxidanylidene-quinoline-4-carboxylate Openeye Name: isopentyl 1-isopentyl-2-oxo-quinoline-4-carboxylate CAS Name: 1-(3-methylbutyl)-2-oxo-4-quinolinecarboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 1-(3-methylbutyl)-2-oxoquinoline-4-carboxylate Traditional Name: 1-isoamyl-2-keto-cinchoninic acid isoamyl ester Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2C(=CC1=O)C(=O)OCCC(C)C

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2C(=CC1=O)C(=O)OCCC(C)C

InChI

InChI=1S/C20H27NO3/c1-14(2)9-11-21-18-8-6-5-7-16(18)17(13-19(21)22)20(23)24-12-10-15(3)4/h5-8,13-15H,9-12H2,1-4H3