3-[4-(isocyanomethyl)phenoxy]-3-methyl-butan-2-one

Systemtic Name: 3-[4-(isocyanomethyl)phenoxy]-3-methyl-butan-2-one Openeye Name: 3-[4-(isocyanomethyl)phenoxy]-3-methyl-butan-2-one CAS Name: 3-[4-(isocyanomethyl)phenoxy]-3-methyl-2-butanone IUPAC Name: 3-[4-(isocyanomethyl)phenoxy]-3-methylbutan-2-one Traditional Name: 3-[4-(isocyanomethyl)phenoxy]-3-methyl-butan-2-one Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C)OC1=CC=C(C=C1)C[N+]#[C-]

Isomeric SMILES

CC(=O)C(C)(C)OC1=CC=C(C=C1)C[N+]#[C-]

InChI

InChI=1S/C13H15NO2/c1-10(15)13(2,3)16-12-7-5-11(6-8-12)9-14-4/h5-8H,9H2,1-3H3