Molecule ID: 91826560

IUPAC Name: 4-[(4-anilinophenyl)-(4-phenyliminocyclohexa-2,5-dien-1-ylidene)methyl]-N-phenylaniline;hydron

Description: The molecule is an organic cation obtained by protonation of spirit blue base. It is a conjugate acid of a spirit blue base.

SMILES: C1=CC(=C(c2ccc(Nc3ccccc3)cc2)c2ccc([NH2+]c3ccccc3)cc2)C=CC1=Nc1ccccc1

SELFIES: [C][=C][C][=Branch2][Ring2][O][=C][Branch2][Ring1][Ring2][C][=C][C][=C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=N][C][=C][C][=C][Branch1][#Branch2][NH2+1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=N][C][=C][C][Ring2][Ring1][P][=N][C][=C][C][=C][C][=C][Ring1][=Branch1]

InChI: InChI=1S/C37H29N3/c1-4-10-31(11-5-1)38-34-22-16-28(17-23-34)37(29-18-24-35(25-19-29)39-32-12-6-2-7-13-32)30-20-26-36(27-21-30)40-33-14-8-3-9-15-33/h1-27,38-39H/p+1

Molecular Properties:
- Polar Surface Area: 36.4 Ų
- LogP: nan