tert-butyl 4-[2-(4-chloranyl-2-oxidanylidene-3H-imidazo[4,5-c]quinolin-1-yl)ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(4-chloranyl-2-oxidanylidene-3H-imidazo[4,5-c]quinolin-1-yl)ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(4-chloro-2-oxo-3H-imidazo[4,5-c]quinolin-1-yl)ethyl]piperidine-1-carboxylate CAS Name: 4-[2-(4-chloro-2-oxo-3H-imidazo[4,5-c]quinolin-1-yl)ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(4-chloro-2-oxo-3H-imidazo[4,5-c]quinolin-1-yl)ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-(4-chloro-2-keto-3H-imidazo[4,5-c]quinolin-1-yl)ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H27ClN4O3 MolecularWeight: 430.92778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCN2C3=C(C(=NC4=CC=CC=C43)Cl)NC2=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCN2C3=C(C(=NC4=CC=CC=C43)Cl)NC2=O

InChI

InChI=1S/C22H27ClN4O3/c1-22(2,3)30-21(29)26-11-8-14(9-12-26)10-13-27-18-15-6-4-5-7-16(15)24-19(23)17(18)25-20(27)28/h4-7,14H,8-13H2,1-3H3,(H,25,28)