4-[1H-benzimidazol-2-ylmethyl(phenyl)amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 4-[1H-benzimidazol-2-ylmethyl(phenyl)amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[N-(1H-benzimidazol-2-ylmethyl)anilino]-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 4-[N-(1H-benzimidazol-2-ylmethyl)anilino]-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-[N-(1H-benzimidazol-2-ylmethyl)anilino]-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[N-(1H-benzimidazol-2-ylmethyl)anilino]-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CC3=NC4=CC=CC=C4N3)C5=CC=CC=C5)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CC3=NC4=CC=CC=C4N3)C5=CC=CC=C5)O)C

InChI

InChI=1S/C26H24N4O2/c1-26(2)25(31)24(19-14-17(15-27)12-13-22(19)32-26)30(18-8-4-3-5-9-18)16-23-28-20-10-6-7-11-21(20)29-23/h3-14,24-25,31H,16H2,1-2H3,(H,28,29)