phenyl 3-isocyano-3-methyl-butanoate

Systemtic Name: phenyl 3-isocyano-3-methyl-butanoate Openeye Name: phenyl 3-isocyano-3-methyl-butanoate CAS Name: 3-isocyano-3-methylbutanoic acid phenyl ester IUPAC Name: phenyl 3-isocyano-3-methylbutanoate Traditional Name: 3-isocyano-3-methyl-butyric acid phenyl ester Formula: C12H13NO2 MolecularWeight: 203.23712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO2/c1-12(2,13-3)9-11(14)15-10-7-5-4-6-8-10/h4-8H,9H2,1-2H3