(3,3-dimethyl-2-oxidanylidene-butyl) 2-methylquinoline-4-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-methylquinoline-4-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C17H19NO3/c1-11-9-13(12-7-5-6-8-14(12)18-11)16(20)21-10-15(19)17(2,3)4/h5-9H,10H2,1-4H3