(2R)-2-isocyanato-4-methyl-2-pyridin-4-yl-pentanal

Systemtic Name: (2R)-2-isocyanato-4-methyl-2-pyridin-4-yl-pentanal Openeye Name: (2R)-2-isocyanato-4-methyl-2-(4-pyridyl)pentanal CAS Name: (2R)-2-isocyanato-4-methyl-2-pyridin-4-ylpentanal IUPAC Name: (2R)-2-isocyanato-4-methyl-2-pyridin-4-ylpentanal Traditional Name: (2R)-2-isocyanato-4-methyl-2-(4-pyridyl)valeraldehyde Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=O)(C1=CC=NC=C1)N=C=O

Isomeric SMILES

CC(C)C[C@](C=O)(C1=CC=NC=C1)N=C=O

InChI

InChI=1S/C12H14N2O2/c1-10(2)7-12(8-15,14-9-16)11-3-5-13-6-4-11/h3-6,8,10H,7H2,1-2H3/t12-/m0/s1