[2-(tert-butylamino)-2-oxidanylidene-ethyl] 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 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 [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 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-(tert-butylamino)-2-keto-ethyl] ester Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3/c1-21(2,3)23-18(24)13-26-20(25)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,(H,23,24)