4-nonanoylbenzenecarbonitrile

Systemtic Name: 4-nonanoylbenzenecarbonitrile Openeye Name: 4-nonanoylbenzonitrile CAS Name: 4-(1-oxononyl)benzonitrile IUPAC Name: 4-nonanoylbenzonitrile Traditional Name: 4-pelargonylbenzonitrile Formula: C16H21NO MolecularWeight: 243.34404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)C1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCCCCCC(=O)C1=CC=C(C=C1)C#N

InChI

InChI=1S/C16H21NO/c1-2-3-4-5-6-7-8-16(18)15-11-9-14(13-17)10-12-15/h9-12H,2-8H2,1H3