[4-[[(2-chloranylquinolin-4-yl)carbonylamino]methyl]cyclohexyl]methyl N-tert-butylcarbamate

Systemtic Name: [4-[[(2-chloranylquinolin-4-yl)carbonylamino]methyl]cyclohexyl]methyl N-tert-butylcarbamate Openeye Name: [4-[[(2-chloroquinoline-4-carbonyl)amino]methyl]cyclohexyl]methyl N-tert-butylcarbamate CAS Name: N-tert-butylcarbamic acid [4-[[[(2-chloro-4-quinolinyl)-oxomethyl]amino]methyl]cyclohexyl]methyl ester IUPAC Name: [4-[[(2-chloroquinoline-4-carbonyl)amino]methyl]cyclohexyl]methyl N-tert-butylcarbamate Traditional Name: N-tert-butylcarbamic acid [4-[[(2-chloroquinoline-4-carbonyl)amino]methyl]cyclohexyl]methyl ester Formula: C23H30ClN3O3 MolecularWeight: 431.9556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)OCC1CCC(CC1)CNC(=O)C2=CC(=NC3=CC=CC=C32)Cl

Isomeric SMILES

CC(C)(C)NC(=O)OCC1CCC(CC1)CNC(=O)C2=CC(=NC3=CC=CC=C32)Cl

InChI

InChI=1S/C23H30ClN3O3/c1-23(2,3)27-22(29)30-14-16-10-8-15(9-11-16)13-25-21(28)18-12-20(24)26-19-7-5-4-6-17(18)19/h4-7,12,15-16H,8-11,13-14H2,1-3H3,(H,25,28)(H,27,29)