4-[1-(3-methylimidazol-4-yl)-1-oxidanyl-3-(2-phenylphenyl)prop-2-ynyl]benzenecarbonitrile

Systemtic Name: 4-[1-(3-methylimidazol-4-yl)-1-oxidanyl-3-(2-phenylphenyl)prop-2-ynyl]benzenecarbonitrile Openeye Name: 4-[1-hydroxy-1-(3-methylimidazol-4-yl)-3-(2-phenylphenyl)prop-2-ynyl]benzonitrile CAS Name: 4-[1-hydroxy-1-(3-methyl-4-imidazolyl)-3-(2-phenylphenyl)prop-2-ynyl]benzonitrile IUPAC Name: 4-[1-hydroxy-1-(3-methylimidazol-4-yl)-3-(2-phenylphenyl)prop-2-ynyl]benzonitrile Traditional Name: 4-[1-hydroxy-1-(3-methylimidazol-4-yl)-3-(2-phenylphenyl)prop-2-ynyl]benzonitrile Formula: C26H19N3O MolecularWeight: 389.44856

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C#CC2=CC=CC=C2C3=CC=CC=C3)(C4=CC=C(C=C4)C#N)O

Isomeric SMILES

CN1C=NC=C1C(C#CC2=CC=CC=C2C3=CC=CC=C3)(C4=CC=C(C=C4)C#N)O

InChI

InChI=1S/C26H19N3O/c1-29-19-28-18-25(29)26(30,23-13-11-20(17-27)12-14-23)16-15-22-9-5-6-10-24(22)21-7-3-2-4-8-21/h2-14,18-19,30H,1H3