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propan-2-yl (2S)-2-isocyanatobutanoate

propan-2-yl (2S)-2-isocyanatobutanoate

Systemtic Name:propan-2-yl (2S)-2-isocyanatobutanoate
Openeye Name:isopropyl (2S)-2-isocyanatobutanoate
CAS Name:(2S)-2-isocyanatobutanoic acid propan-2-yl ester
IUPAC Name:propan-2-yl (2S)-2-isocyanatobutanoate
Traditional Name:(2S)-2-isocyanatobutyric acid isopropyl ester
Formula: C8H13NO3
MolecularWeight: 171.19372
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC(C)C)N=C=O


Isomeric SMILES

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


InChI

InChI=1S/C8H13NO3/c1-4-7(9-5-10)8(11)12-6(2)3/h6-7H,4H2,1-3H3/t7-/m0/s1


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