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

Systemtic Name: 4-[1H-imidazol-2-ylmethyl(phenyl)amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-4-[N-(1H-imidazol-2-ylmethyl)anilino]-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 3-hydroxy-4-[N-(1H-imidazol-2-ylmethyl)anilino]-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-4-[N-(1H-imidazol-2-ylmethyl)anilino]-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-4-[N-(1H-imidazol-2-ylmethyl)anilino]-2,2-dimethyl-chroman-6-carbonitrile Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CC3=NC=CN3)C4=CC=CC=C4)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(CC3=NC=CN3)C4=CC=CC=C4)O)C

InChI

InChI=1S/C22H22N4O2/c1-22(2)21(27)20(17-12-15(13-23)8-9-18(17)28-22)26(14-19-24-10-11-25-19)16-6-4-3-5-7-16/h3-12,20-21,27H,14H2,1-2H3,(H,24,25)