3-[(4-propan-2-ylphenyl)methyl]-1H-benzimidazol-3-ium-2-carbaldehyde

Systemtic Name: 3-[(4-propan-2-ylphenyl)methyl]-1H-benzimidazol-3-ium-2-carbaldehyde Openeye Name: 3-[(4-isopropylphenyl)methyl]-1H-benzimidazol-3-ium-2-carbaldehyde CAS Name: 3-[(4-propan-2-ylphenyl)methyl]-1H-benzimidazol-3-ium-2-carboxaldehyde IUPAC Name: 3-[(4-propan-2-ylphenyl)methyl]-1H-benzimidazol-3-ium-2-carbaldehyde Traditional Name: 3-(4-isopropylbenzyl)-1H-benzimidazol-3-ium-2-carbaldehyde Formula: C18H19N2O+ MolecularWeight: 279.35626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)C=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)C=O

InChI

InChI=1S/C18H18N2O/c1-13(2)15-9-7-14(8-10-15)11-20-17-6-4-3-5-16(17)19-18(20)12-21/h3-10,12-13H,11H2,1-2H3/p+1