[5-[2-(ethylamino)-1-oxidanyl-butyl]-2-oxidanylidene-1H-quinolin-8-yl] 3-cyclohexylbutanoate hydrochloride

Systemtic Name: [5-[2-(ethylamino)-1-oxidanyl-butyl]-2-oxidanylidene-1H-quinolin-8-yl] 3-cyclohexylbutanoate hydrochloride Openeye Name: [5-[2-(ethylamino)-1-hydroxy-butyl]-2-oxo-1H-quinolin-8-yl] 3-cyclohexylbutanoate hydrochloride CAS Name: 3-cyclohexylbutanoic acid [5-[2-(ethylamino)-1-hydroxybutyl]-2-oxo-1H-quinolin-8-yl] ester hydrochloride IUPAC Name: [5-[2-(ethylamino)-1-hydroxybutyl]-2-oxo-1H-quinolin-8-yl] 3-cyclohexylbutanoate hydrochloride Traditional Name: 3-cyclohexylbutyric acid [5-[2-(ethylamino)-1-hydroxy-butyl]-2-keto-1H-quinolin-8-yl] ester hydrochloride Formula: C25H37ClN2O4 MolecularWeight: 465.02528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)CC(C)C3CCCCC3)O)NCC.Cl

Isomeric SMILES

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)CC(C)C3CCCCC3)O)NCC.Cl

InChI

InChI=1S/C25H36N2O4.ClH/c1-4-20(26-5-2)25(30)19-11-13-21(24-18(19)12-14-22(28)27-24)31-23(29)15-16(3)17-9-7-6-8-10-17;/h11-14,16-17,20,25-26,30H,4-10,15H2,1-3H3,(H,27,28);1H