3-methyl-4-[4-(3-oxidanyl-5-pyridin-3-yl-pentan-2-yl)oxyphenyl]benzenecarbonitrile

Systemtic Name: 3-methyl-4-[4-(3-oxidanyl-5-pyridin-3-yl-pentan-2-yl)oxyphenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-hydroxy-1-methyl-4-(3-pyridyl)butoxy]phenyl]-3-methyl-benzonitrile CAS Name: 4-[4-[3-hydroxy-5-(3-pyridinyl)pentan-2-yl]oxyphenyl]-3-methylbenzonitrile IUPAC Name: 4-[4-(3-hydroxy-5-pyridin-3-ylpentan-2-yl)oxyphenyl]-3-methylbenzonitrile Traditional Name: 4-[4-[2-hydroxy-1-methyl-4-(3-pyridyl)butoxy]phenyl]-3-methyl-benzonitrile Formula: C24H24N2O2 MolecularWeight: 372.45956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)OC(C)C(CCC3=CN=CC=C3)O

Isomeric SMILES

CC1=C(C=CC(=C1)C#N)C2=CC=C(C=C2)OC(C)C(CCC3=CN=CC=C3)O

InChI

InChI=1S/C24H24N2O2/c1-17-14-20(15-25)5-11-23(17)21-7-9-22(10-8-21)28-18(2)24(27)12-6-19-4-3-13-26-16-19/h3-5,7-11,13-14,16,18,24,27H,6,12H2,1-2H3