[2-[(2-butyl-3-propyl-quinolin-4-yl)amino]-2-oxidanylidene-ethyl]-dipentyl-azanium

Systemtic Name: [2-[(2-butyl-3-propyl-quinolin-4-yl)amino]-2-oxidanylidene-ethyl]-dipentyl-azanium Openeye Name: [2-[(2-butyl-3-propyl-4-quinolyl)amino]-2-oxo-ethyl]-dipentyl-ammonium CAS Name: [2-[(2-butyl-3-propyl-4-quinolinyl)amino]-2-oxoethyl]-dipentylammonium IUPAC Name: [2-[(2-butyl-3-propylquinolin-4-yl)amino]-2-oxoethyl]-dipentylazanium Traditional Name: diamyl-[2-[(2-butyl-3-propyl-4-quinolyl)amino]-2-keto-ethyl]ammonium Formula: C28H46N3O+ MolecularWeight: 440.68434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH+](CCCCC)CC(=O)NC1=C(C(=NC2=CC=CC=C21)CCCC)CCC

Isomeric SMILES

CCCCC[NH+](CCCCC)CC(=O)NC1=C(C(=NC2=CC=CC=C21)CCCC)CCC

InChI

InChI=1S/C28H45N3O/c1-5-9-14-20-31(21-15-10-6-2)22-27(32)30-28-23(16-8-4)25(18-11-7-3)29-26-19-13-12-17-24(26)28/h12-13,17,19H,5-11,14-16,18,20-22H2,1-4H3,(H,29,30,32)/p+1