3-[2-[butyl(diethyl)azaniumyl]ethylcarbamoyl]-4-oxidanylidene-1-propyl-quinolin-2-olate

Systemtic Name: 3-[2-[butyl(diethyl)azaniumyl]ethylcarbamoyl]-4-oxidanylidene-1-propyl-quinolin-2-olate Openeye Name: 3-[2-[butyl(diethyl)ammonio]ethylcarbamoyl]-4-oxo-1-propyl-quinolin-2-olate CAS Name: 3-[[2-[butyl(diethyl)ammonio]ethylamino]-oxomethyl]-4-oxo-1-propyl-2-quinolinolate IUPAC Name: 3-[2-[butyl(diethyl)azaniumyl]ethylcarbamoyl]-4-oxo-1-propylquinolin-2-olate Traditional Name: 3-[2-[butyl(diethyl)ammonio]ethylcarbamoyl]-4-keto-1-propyl-quinolin-2-olate Formula: C23H35N3O3 MolecularWeight: 401.5423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CC)(CC)CCNC(=O)C1=C(N(C2=CC=CC=C2C1=O)CCC)[O-]

Isomeric SMILES

CCCC[N+](CC)(CC)CCNC(=O)C1=C(N(C2=CC=CC=C2C1=O)CCC)[O-]

InChI

InChI=1S/C23H35N3O3/c1-5-9-16-26(7-3,8-4)17-14-24-22(28)20-21(27)18-12-10-11-13-19(18)25(15-6-2)23(20)29/h10-13H,5-9,14-17H2,1-4H3,(H-,24,27,28,29)