3-[8-(6,7-dimethylnaphthalen-2-yl)octan-2-yl]benzenecarbonitrile

Systemtic Name: 3-[8-(6,7-dimethylnaphthalen-2-yl)octan-2-yl]benzenecarbonitrile Openeye Name: 3-[7-(6,7-dimethyl-2-naphthyl)-1-methyl-heptyl]benzonitrile CAS Name: 3-[8-(6,7-dimethyl-2-naphthalenyl)octan-2-yl]benzonitrile IUPAC Name: 3-[8-(6,7-dimethylnaphthalen-2-yl)octan-2-yl]benzonitrile Traditional Name: 3-[7-(6,7-dimethyl-2-naphthyl)-1-methyl-heptyl]benzonitrile Formula: C27H31N MolecularWeight: 369.54174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=C1)CCCCCCC(C)C3=CC=CC(=C3)C#N)C

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=C1)CCCCCCC(C)C3=CC=CC(=C3)C#N)C

InChI

InChI=1S/C27H31N/c1-20(25-12-8-11-24(18-25)19-28)9-6-4-5-7-10-23-13-14-26-15-21(2)22(3)16-27(26)17-23/h8,11-18,20H,4-7,9-10H2,1-3H3