2-(2-azanyl-3-prop-2-enyl-benzimidazol-3-ium-1-yl)-1-(4-phenylphenyl)ethanol chloride

Systemtic Name: 2-(2-azanyl-3-prop-2-enyl-benzimidazol-3-ium-1-yl)-1-(4-phenylphenyl)ethanol chloride Openeye Name: 2-(3-allyl-2-amino-benzimidazol-3-ium-1-yl)-1-(4-phenylphenyl)ethanol chloride CAS Name: 2-(2-amino-3-prop-2-enyl-1-benzimidazol-3-iumyl)-1-(4-phenylphenyl)ethanol chloride IUPAC Name: 2-(2-amino-3-prop-2-enylbenzimidazol-3-ium-1-yl)-1-(4-phenylphenyl)ethanol chloride Traditional Name: 2-(3-allyl-2-amino-benzimidazol-3-ium-1-yl)-1-(4-phenylphenyl)ethanol chloride Formula: C24H24ClN3O MolecularWeight: 405.91986

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=C(N(C2=CC=CC=C21)CC(C3=CC=C(C=C3)C4=CC=CC=C4)O)N.[Cl-]

Isomeric SMILES

C=CC[N+]1=C(N(C2=CC=CC=C21)CC(C3=CC=C(C=C3)C4=CC=CC=C4)O)N.[Cl-]

InChI

InChI=1S/C24H23N3O.ClH/c1-2-16-26-21-10-6-7-11-22(21)27(24(26)25)17-23(28)20-14-12-19(13-15-20)18-8-4-3-5-9-18;/h2-15,23,25,28H,1,16-17H2;1H