2-ethyl-5-methyl-3-nonyl-benzenecarbonitrile

Systemtic Name: 2-ethyl-5-methyl-3-nonyl-benzenecarbonitrile Openeye Name: 2-ethyl-5-methyl-3-nonyl-benzonitrile CAS Name: 2-ethyl-5-methyl-3-nonylbenzonitrile IUPAC Name: 2-ethyl-5-methyl-3-nonylbenzonitrile Traditional Name: 2-ethyl-5-methyl-3-nonyl-benzonitrile Formula: C19H29N MolecularWeight: 271.44026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=CC(=C1)C)C#N)CC

Isomeric SMILES

CCCCCCCCCC1=C(C(=CC(=C1)C)C#N)CC

InChI

InChI=1S/C19H29N/c1-4-6-7-8-9-10-11-12-17-13-16(3)14-18(15-20)19(17)5-2/h13-14H,4-12H2,1-3H3