2-chloranyl-4-[4-methyl-2-(phenylmethyl)phenoxy]benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-[4-methyl-2-(phenylmethyl)phenoxy]benzenecarbonitrile Openeye Name: 4-(2-benzyl-4-methyl-phenoxy)-2-chloro-benzonitrile CAS Name: 2-chloro-4-[4-methyl-2-(phenylmethyl)phenoxy]benzonitrile IUPAC Name: 4-(2-benzyl-4-methylphenoxy)-2-chlorobenzonitrile Traditional Name: 4-(2-benzyl-4-methyl-phenoxy)-2-chloro-benzonitrile Formula: C21H16ClNO MolecularWeight: 333.81084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=CC(=C(C=C2)C#N)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=CC(=C(C=C2)C#N)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C21H16ClNO/c1-15-7-10-21(18(11-15)12-16-5-3-2-4-6-16)24-19-9-8-17(14-23)20(22)13-19/h2-11,13H,12H2,1H3