3-(8-tert-butyl-2-oxidanylidene-1H-quinolin-3-yl)propylazanium

Systemtic Name: 3-(8-tert-butyl-2-oxidanylidene-1H-quinolin-3-yl)propylazanium Openeye Name: 3-(8-tert-butyl-2-oxo-1H-quinolin-3-yl)propylammonium CAS Name: 3-(8-tert-butyl-2-oxo-1H-quinolin-3-yl)propylammonium IUPAC Name: 3-(8-tert-butyl-2-oxo-1H-quinolin-3-yl)propylazanium Traditional Name: 3-(8-tert-butyl-2-keto-1H-quinolin-3-yl)propylammonium Formula: C16H23N2O+ MolecularWeight: 259.36662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC2=C1NC(=O)C(=C2)CCC[NH3+]

Isomeric SMILES

CC(C)(C)C1=CC=CC2=C1NC(=O)C(=C2)CCC[NH3+]

InChI

InChI=1S/C16H22N2O/c1-16(2,3)13-8-4-6-11-10-12(7-5-9-17)15(19)18-14(11)13/h4,6,8,10H,5,7,9,17H2,1-3H3,(H,18,19)/p+1