4-(hydroxymethyl)-2-(4-phenylbutoxy)benzenecarbonitrile

Systemtic Name: 4-(hydroxymethyl)-2-(4-phenylbutoxy)benzenecarbonitrile Openeye Name: 4-(hydroxymethyl)-2-(4-phenylbutoxy)benzonitrile CAS Name: 4-(hydroxymethyl)-2-(4-phenylbutoxy)benzonitrile IUPAC Name: 4-(hydroxymethyl)-2-(4-phenylbutoxy)benzonitrile Traditional Name: 4-methylol-2-(4-phenylbutoxy)benzonitrile Formula: C18H19NO2 MolecularWeight: 281.34896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC2=C(C=CC(=C2)CO)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC2=C(C=CC(=C2)CO)C#N

InChI

InChI=1S/C18H19NO2/c19-13-17-10-9-16(14-20)12-18(17)21-11-5-4-8-15-6-2-1-3-7-15/h1-3,6-7,9-10,12,20H,4-5,8,11,14H2