2-methyl-2-[3-(6-oxidanylnaphthalen-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]propanenitrile

Systemtic Name: 2-methyl-2-[3-(6-oxidanylnaphthalen-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]propanenitrile Openeye Name: 2-[3-(6-hydroxy-2-naphthyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methyl-propanenitrile CAS Name: 2-[3-(6-hydroxy-2-naphthalenyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile IUPAC Name: 2-[3-(6-hydroxynaphthalen-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile Traditional Name: 2-[3-(6-hydroxy-2-naphthyl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methyl-propionitrile Formula: C23H20N4O MolecularWeight: 368.4311

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC(=CC(=C1)CN2C=NC=N2)C3=CC4=C(C=C3)C=C(C=C4)O

Isomeric SMILES

CC(C)(C#N)C1=CC(=CC(=C1)CN2C=NC=N2)C3=CC4=C(C=C3)C=C(C=C4)O

InChI

InChI=1S/C23H20N4O/c1-23(2,13-24)21-8-16(12-27-15-25-14-26-27)7-20(10-21)18-3-4-19-11-22(28)6-5-17(19)9-18/h3-11,14-15,28H,12H2,1-2H3