3-oxidanylidene-3-(4-propylphenyl)propanenitrile

Systemtic Name: 3-oxidanylidene-3-(4-propylphenyl)propanenitrile Openeye Name: 3-oxo-3-(4-propylphenyl)propanenitrile CAS Name: 3-oxo-3-(4-propylphenyl)propanenitrile IUPAC Name: 3-oxo-3-(4-propylphenyl)propanenitrile Traditional Name: 3-keto-3-(4-propylphenyl)propionitrile Formula: C12H13NO MolecularWeight: 187.23772

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)CC#N

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)CC#N

InChI

InChI=1S/C12H13NO/c1-2-3-10-4-6-11(7-5-10)12(14)8-9-13/h4-7H,2-3,8H2,1H3