(3,3-dimethyl-2-oxidanylidene-butyl) 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate CAS Name: 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate Traditional Name: 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=C2CCCCCC2=NC3=CC=CC=C31

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=C2CCCCCC2=NC3=CC=CC=C31

InChI

InChI=1S/C21H25NO3/c1-21(2,3)18(23)13-25-20(24)19-14-9-5-4-6-11-16(14)22-17-12-8-7-10-15(17)19/h7-8,10,12H,4-6,9,11,13H2,1-3H3