[5-[2-(tert-butylamino)-1-oxidanyl-propyl]-2-oxidanylidene-1H-quinolin-8-yl] 2-methylpropanoate

Systemtic Name: [5-[2-(tert-butylamino)-1-oxidanyl-propyl]-2-oxidanylidene-1H-quinolin-8-yl] 2-methylpropanoate Openeye Name: [5-[2-(tert-butylamino)-1-hydroxy-propyl]-2-oxo-1H-quinolin-8-yl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [5-[2-(tert-butylamino)-1-hydroxypropyl]-2-oxo-1H-quinolin-8-yl] ester IUPAC Name: [5-[2-(tert-butylamino)-1-hydroxypropyl]-2-oxo-1H-quinolin-8-yl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [5-[2-(tert-butylamino)-1-hydroxy-propyl]-2-keto-1H-quinolin-8-yl] ester Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC1=C2C(=C(C=C1)C(C(C)NC(C)(C)C)O)C=CC(=O)N2

Isomeric SMILES

CC(C)C(=O)OC1=C2C(=C(C=C1)C(C(C)NC(C)(C)C)O)C=CC(=O)N2

InChI

InChI=1S/C20H28N2O4/c1-11(2)19(25)26-15-9-7-14(13-8-10-16(23)21-17(13)15)18(24)12(3)22-20(4,5)6/h7-12,18,22,24H,1-6H3,(H,21,23)