8-(1H-imidazol-2-ylmethyl)-2,2-dimethyl-3-oxidanyl-4-phenylazanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 8-(1H-imidazol-2-ylmethyl)-2,2-dimethyl-3-oxidanyl-4-phenylazanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-anilino-3-hydroxy-8-(1H-imidazol-2-ylmethyl)-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 4-anilino-3-hydroxy-8-(1H-imidazol-2-ylmethyl)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-anilino-3-hydroxy-8-(1H-imidazol-2-ylmethyl)-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-anilino-3-hydroxy-8-(1H-imidazol-2-ylmethyl)-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)CC3=NC=CN3)NC4=CC=CC=C4)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C(=CC(=C2)C#N)CC3=NC=CN3)NC4=CC=CC=C4)O)C

InChI

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