methyl (2S)-2-isocyano-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-isocyano-3-methyl-butanoate Openeye Name: methyl (2S)-2-isocyano-3-methyl-butanoate CAS Name: (2S)-2-isocyano-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-isocyano-3-methylbutanoate Traditional Name: (2S)-2-isocyano-3-methyl-butyric acid methyl ester Formula: C7H11NO2 MolecularWeight: 141.16774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)[N+]#[C-]

InChI

InChI=1S/C7H11NO2/c1-5(2)6(8-3)7(9)10-4/h5-6H,1-2,4H3/t6-/m0/s1