Molecule ID: 4141003

IUPAC Name: [4-[bis(4-aminophenyl)methylidene]-2-methylcyclohexa-2,5-dien-1-ylidene]azanium

Description: The molecule is an iminium ion obtained by protonation of the imino group of rosanilin free base. It is a conjugate acid of a rosanilin free base.

SMILES: CC1=CC(=C(c2ccc(N)cc2)c2ccc([NH3+])cc2)C=CC1=N

SELFIES: [C][C][=C][C][=Branch2][Ring1][#Branch2][=C][Branch1][N][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][C][NH3+1][C][=C][Ring1][#Branch1][C][=C][C][Ring2][Ring1][Branch1][=N]

InChI: InChI=1S/C20H19N3/c1-13-12-16(6-11-19(13)23)20(14-2-7-17(21)8-3-14)15-4-9-18(22)10-5-15/h2-12,23H,21-22H2,1H3/p+1

Molecular Properties:
- Polar Surface Area: 77.6 Ų
- LogP: 3.7