Molecule ID: 5249877

IUPAC Name: tert-butyl-[2-hydroxy-3-[(2-oxo-3,4-dihydro-1H-quinolin-5-yl)oxy]propyl]azanium

Description: The molecule is the ammonium ion resulting from the protonation of the side-chain amino group of carteolol. It is a conjugate acid of a carteolol.

SMILES: CC(C)(C)[NH2+]CC(O)COc1cccc2c1CCC(O)=N2

SELFIES: [C][C][Branch1][C][C][Branch1][C][C][NH2+1][C][C][Branch1][C][O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Branch1][C][O][=N][Ring1][#Branch1]

InChI: InChI=1S/C16H24N2O3/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20)/p+1

Molecular Properties:
- Polar Surface Area: 75.2 Ų
- LogP: 1.0