3-[1-(4-chlorophenyl)-3-oxidanyl-butan-2-yl]benzenecarbonitrile

Systemtic Name: 3-[1-(4-chlorophenyl)-3-oxidanyl-butan-2-yl]benzenecarbonitrile Openeye Name: 3-[1-[(4-chlorophenyl)methyl]-2-hydroxy-propyl]benzonitrile CAS Name: 3-[1-(4-chlorophenyl)-3-hydroxybutan-2-yl]benzonitrile IUPAC Name: 3-[1-(4-chlorophenyl)-3-hydroxybutan-2-yl]benzonitrile Traditional Name: 3-[1-(4-chlorobenzyl)-2-hydroxy-propyl]benzonitrile Formula: C17H16ClNO MolecularWeight: 285.76804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=C(C=C1)Cl)C2=CC=CC(=C2)C#N)O

Isomeric SMILES

CC(C(CC1=CC=C(C=C1)Cl)C2=CC=CC(=C2)C#N)O

InChI

InChI=1S/C17H16ClNO/c1-12(20)17(10-13-5-7-16(18)8-6-13)15-4-2-3-14(9-15)11-19/h2-9,12,17,20H,10H2,1H3