2-(1,3-dihydrobenzimidazol-2-ylideneazaniumylmethyl)-4-methyl-phenolate

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylideneazaniumylmethyl)-4-methyl-phenolate Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylideneammoniomethyl)-4-methyl-phenolate CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylideneammoniomethyl)-4-methylphenolate IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylideneazaniumylmethyl)-4-methylphenolate Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylideneammoniomethyl)-4-methyl-phenolate Formula: C15H15N3O MolecularWeight: 253.2991

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[O-])C[NH+]=C2NC3=CC=CC=C3N2

Isomeric SMILES

CC1=CC(=C(C=C1)[O-])C[NH+]=C2NC3=CC=CC=C3N2

InChI

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