1-azido-3,3-dimethyl-4-(4-methylphenyl)butan-1-one

Systemtic Name: 1-azido-3,3-dimethyl-4-(4-methylphenyl)butan-1-one Openeye Name: 3,3-dimethyl-4-(p-tolyl)butanoyl azide CAS Name: 1-azido-3,3-dimethyl-4-(4-methylphenyl)-1-butanone IUPAC Name: 3,3-dimethyl-4-(4-methylphenyl)butanoyl azide Traditional Name: 1-azido-3,3-dimethyl-4-(p-tolyl)butan-1-one Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O/c1-10-4-6-11(7-5-10)8-13(2,3)9-12(17)15-16-14/h4-7H,8-9H2,1-3H3