1-[4-(1-azido-3-methyl-but-2-en-2-yl)phenyl]ethanone

Systemtic Name: 1-[4-(1-azido-3-methyl-but-2-en-2-yl)phenyl]ethanone Openeye Name: 1-[4-[1-(azidomethyl)-2-methyl-prop-1-enyl]phenyl]ethanone CAS Name: 1-[4-(1-azido-3-methylbut-2-en-2-yl)phenyl]ethanone IUPAC Name: 1-[4-(1-azido-3-methylbut-2-en-2-yl)phenyl]ethanone Traditional Name: 1-[4-[1-(azidomethyl)-2-methyl-prop-1-enyl]phenyl]ethanone Formula: C13H15N3O MolecularWeight: 229.2777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O/c1-9(2)13(8-15-16-14)12-6-4-11(5-7-12)10(3)17/h4-7H,8H2,1-3H3