2,4-bis(chloranyl)-6-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenol

Systemtic Name: 2,4-bis(chloranyl)-6-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenol Openeye Name: 2,4-dichloro-6-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenol CAS Name: 2,4-dichloro-6-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenol IUPAC Name: 2,4-dichloro-6-[[(3-pentyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]phenol Traditional Name: 2-[[(3-amyl-1H-benzimidazol-3-ium-2-yl)amino]methyl]-4,6-dichloro-phenol Formula: C19H22Cl2N3O+ MolecularWeight: 379.30348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1=C(NC2=CC=CC=C21)NCC3=CC(=CC(=C3O)Cl)Cl

Isomeric SMILES

CCCCC[N+]1=C(NC2=CC=CC=C21)NCC3=CC(=CC(=C3O)Cl)Cl

InChI

InChI=1S/C19H21Cl2N3O/c1-2-3-6-9-24-17-8-5-4-7-16(17)23-19(24)22-12-13-10-14(20)11-15(21)18(13)25/h4-5,7-8,10-11H,2-3,6,9,12H2,1H3,(H2,22,23,25)/p+1