Molecule ID: 16218546

IUPAC Name: 4-[9-(dimethylamino)-11,11-dimethyl-3,4-dihydro-2H-naphtho[2,3-g]quinolin-1-ium-1-yl]butanoic acid;perchlorate

Description: The molecule is an organic heterotetracyclic compound and an organic perchlorate salt. It has a role as a fluorochrome. It contains an ATTO 610-2(1+).

SMILES: CN(C)c1ccc2c(c1)C(C)(C)c1cc3c(cc1=C2)CCC[N+]=3CCCC(=O)[O-].[O-][Cl+3]([O-])([O-])O

SELFIES: [C][N][Branch1][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C][=C][C][C][=Branch1][Branch2][=C][C][Ring1][=Branch1][=C][Ring1][=N][C][C][C][N+1][=Ring1][=Branch2][C][C][C][C][=Branch1][C][=O][O-1].[O-1][Cl+3][Branch1][C][O-1][Branch1][C][O-1][O]

InChI: InChI=1S/C25H30N2O2.ClHO4/c1-25(2)21-15-20(26(3)4)10-9-17(21)13-19-14-18-7-5-11-27(12-6-8-24(28)29)23(18)16-22(19)25;2-1(3,4)5/h9-10,13-16H,5-8,11-12H2,1-4H3;(H,2,3,4,5)

Molecular Properties:
- Polar Surface Area: 118.0 Ų
- LogP: nan