Molecule ID: 86308369

IUPAC Name: [amino-[4-[3-[4-[amino(azaniumylidene)methyl]phenoxy]propoxy]phenyl]methylidene]azanium

Description: The molecule is a guanidinium ion obtained by protonation of both guanidino groups of propamidine. It is a conjugate acid of a propamidine.

SMILES: N=C(N)c1ccc(OCCCOc2ccc(C(=[NH2+])[NH3+])cc2)cc1

SELFIES: [N][=C][Branch1][C][N][C][=C][C][=C][Branch2][Ring1][Branch1][O][C][C][C][O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=NH2+1][NH3+1][C][=C][Ring1][=Branch2][C][=C][Ring2][Ring1][Ring2]

InChI: InChI=1S/C17H20N4O2/c18-16(19)12-2-6-14(7-3-12)22-10-1-11-23-15-8-4-13(5-9-15)17(20)21/h2-9H,1,10-11H2,(H3,18,19)(H3,20,21)/p+2

Molecular Properties:
- Polar Surface Area: 122.0 Ų
- LogP: 1.8