3-[[4-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-4-cyano-2-methyl-pyrido[1,2-a]benzimidazol-1-olate

Systemtic Name: 3-[[4-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-4-cyano-2-methyl-pyrido[1,2-a]benzimidazol-1-olate Openeye Name: 3-[[4-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-4-cyano-2-methyl-pyrido[1,2-a]benzimidazol-1-olate CAS Name: 3-[[4-(1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-4-cyano-2-methyl-1-pyrido[1,2-a]benzimidazololate IUPAC Name: 3-[[4-(1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-4-cyano-2-methylpyrido[1,2-a]benzimidazol-1-olate Traditional Name: 3-[[4-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-4-cyano-2-methyl-pyrido[1,2-a]benzimidazol-1-olate Formula: C28H18N5O2- MolecularWeight: 456.47482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3O2)N=CC4=C(C5=NC6=CC=CC=C6N5C(=C4C)[O-])C#N

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3O2)N=CC4=C(C5=NC6=CC=CC=C6N5C(=C4C)[O-])C#N

InChI

InChI=1S/C28H19N5O2/c1-16-13-18(27-32-23-8-4-6-10-25(23)35-27)11-12-21(16)30-15-20-17(2)28(34)33-24-9-5-3-7-22(24)31-26(33)19(20)14-29/h3-13,15,34H,1-2H3/p-1