2-methylpropyl 1-cyclohexyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: 2-methylpropyl 1-cyclohexyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: isobutyl 1-cyclohexyl-4-oxo-quinoline-3-carboxylate CAS Name: 1-cyclohexyl-4-oxo-3-quinolinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 1-cyclohexyl-4-oxoquinoline-3-carboxylate Traditional Name: 1-cyclohexyl-4-keto-quinoline-3-carboxylic acid isobutyl ester Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CN(C2=CC=CC=C2C1=O)C3CCCCC3

Isomeric SMILES

CC(C)COC(=O)C1=CN(C2=CC=CC=C2C1=O)C3CCCCC3

InChI

InChI=1S/C20H25NO3/c1-14(2)13-24-20(23)17-12-21(15-8-4-3-5-9-15)18-11-7-6-10-16(18)19(17)22/h6-7,10-12,14-15H,3-5,8-9,13H2,1-2H3