[2-[(2-cyano-3-methyl-butan-2-yl)amino]-2-oxidanylidene-ethyl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate

Systemtic Name: [2-[(2-cyano-3-methyl-butan-2-yl)amino]-2-oxidanylidene-ethyl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate Openeye Name: [2-[(1-cyano-1,2-dimethyl-propyl)amino]-2-oxo-ethyl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate CAS Name: 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid [2-[(2-cyano-3-methylbutan-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-cyano-3-methylbutan-2-yl)amino]-2-oxoethyl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate Traditional Name: 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid [2-[(1-cyano-1,2-dimethyl-propyl)amino]-2-keto-ethyl] ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)COC(=O)C1=C2CCCC2=NC3=CC=CC=C31

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)COC(=O)C1=C2CCCC2=NC3=CC=CC=C31

InChI

InChI=1S/C21H23N3O3/c1-13(2)21(3,12-22)24-18(25)11-27-20(26)19-14-7-4-5-9-16(14)23-17-10-6-8-15(17)19/h4-5,7,9,13H,6,8,10-11H2,1-3H3,(H,24,25)