2-[[(1-methylbenzimidazol-5-yl)azaniumyl]methyl]phenolate

Systemtic Name: 2-[[(1-methylbenzimidazol-5-yl)azaniumyl]methyl]phenolate Openeye Name: 2-[[(1-methylbenzimidazol-5-yl)ammonio]methyl]phenolate CAS Name: 2-[[(1-methyl-5-benzimidazolyl)ammonio]methyl]phenolate IUPAC Name: 2-[[(1-methylbenzimidazol-5-yl)azaniumyl]methyl]phenolate Traditional Name: 2-[[(1-methylbenzimidazol-5-yl)ammonio]methyl]phenolate Formula: C15H15N3O MolecularWeight: 253.2991

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C=CC(=C2)[NH2+]CC3=CC=CC=C3[O-]

Isomeric SMILES

CN1C=NC2=C1C=CC(=C2)[NH2+]CC3=CC=CC=C3[O-]

InChI

InChI=1S/C15H15N3O/c1-18-10-17-13-8-12(6-7-14(13)18)16-9-11-4-2-3-5-15(11)19/h2-8,10,16,19H,9H2,1H3