[5-[2-(tert-butylamino)-1-oxidanyl-butyl]-2-oxidanylidene-1H-quinolin-8-yl] 4-chloranylbenzoate

Systemtic Name: [5-[2-(tert-butylamino)-1-oxidanyl-butyl]-2-oxidanylidene-1H-quinolin-8-yl] 4-chloranylbenzoate Openeye Name: [5-[2-(tert-butylamino)-1-hydroxy-butyl]-2-oxo-1H-quinolin-8-yl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [5-[2-(tert-butylamino)-1-hydroxybutyl]-2-oxo-1H-quinolin-8-yl] ester IUPAC Name: [5-[2-(tert-butylamino)-1-hydroxybutyl]-2-oxo-1H-quinolin-8-yl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [5-[2-(tert-butylamino)-1-hydroxy-butyl]-2-keto-1H-quinolin-8-yl] ester Formula: C24H27ClN2O4 MolecularWeight: 442.93518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)C3=CC=C(C=C3)Cl)O)NC(C)(C)C

Isomeric SMILES

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)C3=CC=C(C=C3)Cl)O)NC(C)(C)C

InChI

InChI=1S/C24H27ClN2O4/c1-5-18(27-24(2,3)4)22(29)17-10-12-19(21-16(17)11-13-20(28)26-21)31-23(30)14-6-8-15(25)9-7-14/h6-13,18,22,27,29H,5H2,1-4H3,(H,26,28)