3-(4-methylphenyl)adamantane-1-carbonitrile

Systemtic Name: 3-(4-methylphenyl)adamantane-1-carbonitrile Openeye Name: 3-(p-tolyl)adamantane-1-carbonitrile CAS Name: 3-(4-methylphenyl)-1-adamantanecarbonitrile IUPAC Name: 3-(4-methylphenyl)adamantane-1-carbonitrile Traditional Name: 3-(p-tolyl)adamantane-1-carbonitrile Formula: C18H21N MolecularWeight: 251.36604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C#N

InChI

InChI=1S/C18H21N/c1-13-2-4-16(5-3-13)18-9-14-6-15(10-18)8-17(7-14,11-18)12-19/h2-5,14-15H,6-11H2,1H3