4-nonylcyclohexane-1-carboxylic acid; 4-phenylbenzenecarbonitrile

Systemtic Name: 4-nonylcyclohexane-1-carboxylic acid; 4-phenylbenzenecarbonitrile Openeye Name: 4-nonylcyclohexanecarboxylic acid; 4-phenylbenzonitrile CAS Name: 4-nonyl-1-cyclohexanecarboxylic acid; 4-phenylbenzonitrile IUPAC Name: 4-nonylcyclohexane-1-carboxylic acid; 4-phenylbenzonitrile Traditional Name: 4-nonylcyclohexanecarboxylic acid; 4-phenylbenzonitrile Formula: C29H39NO2 MolecularWeight: 433.62546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC(CC1)C(=O)O.C1=CC=C(C=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCCCCCC1CCC(CC1)C(=O)O.C1=CC=C(C=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H30O2.C13H9N/c1-2-3-4-5-6-7-8-9-14-10-12-15(13-11-14)16(17)18;14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h14-15H,2-13H2,1H3,(H,17,18);1-9H