4-(5,6-dimethyl-3-propyl-1H-benzimidazol-3-ium-2-yl)aniline

Systemtic Name: 4-(5,6-dimethyl-3-propyl-1H-benzimidazol-3-ium-2-yl)aniline Openeye Name: 4-(5,6-dimethyl-3-propyl-1H-benzimidazol-3-ium-2-yl)aniline CAS Name: 4-(5,6-dimethyl-3-propyl-1H-benzimidazol-3-ium-2-yl)aniline IUPAC Name: 4-(5,6-dimethyl-3-propyl-1H-benzimidazol-3-ium-2-yl)aniline Traditional Name: [4-(5,6-dimethyl-3-propyl-1H-benzimidazol-3-ium-2-yl)phenyl]amine Formula: C18H22N3+ MolecularWeight: 280.38738

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(NC2=C1C=C(C(=C2)C)C)C3=CC=C(C=C3)N

Isomeric SMILES

CCC[N+]1=C(NC2=C1C=C(C(=C2)C)C)C3=CC=C(C=C3)N

InChI

InChI=1S/C18H21N3/c1-4-9-21-17-11-13(3)12(2)10-16(17)20-18(21)14-5-7-15(19)8-6-14/h5-8,10-11H,4,9H2,1-3H3,(H2,19,20)/p+1