N-ethanoyl-2-(2-methylpropyl)-5-propan-2-yl-benzonitrilium

Systemtic Name: N-ethanoyl-2-(2-methylpropyl)-5-propan-2-yl-benzonitrilium Openeye Name: N-acetyl-2-isobutyl-5-isopropyl-benzonitrilium CAS Name: N-acetyl-2-(2-methylpropyl)-5-propan-2-ylbenzonitrilium IUPAC Name: N-acetyl-2-(2-methylpropyl)-5-propan-2-ylbenzonitrilium Traditional Name: N-acetyl-2-isobutyl-5-isopropyl-benzonitrilium Formula: C16H22NO+ MolecularWeight: 244.35198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=C(C=C1)C(C)C)C#[N+]C(=O)C

Isomeric SMILES

CC(C)CC1=C(C=C(C=C1)C(C)C)C#[N+]C(=O)C

InChI

InChI=1S/C16H22NO/c1-11(2)8-15-7-6-14(12(3)4)9-16(15)10-17-13(5)18/h6-7,9,11-12H,8H2,1-5H3/q+1