methyl (3S)-3-(4-fluorophenyl)-3-isocyanato-propanoate

Systemtic Name: methyl (3S)-3-(4-fluorophenyl)-3-isocyanato-propanoate Openeye Name: methyl (3S)-3-(4-fluorophenyl)-3-isocyanato-propanoate CAS Name: (3S)-3-(4-fluorophenyl)-3-isocyanatopropanoic acid methyl ester IUPAC Name: methyl (3S)-3-(4-fluorophenyl)-3-isocyanatopropanoate Traditional Name: (3S)-3-(4-fluorophenyl)-3-isocyanato-propionic acid methyl ester Formula: C11H10FNO3 MolecularWeight: 223.200403

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=C(C=C1)F)N=C=O

Isomeric SMILES

COC(=O)C[C@@H](C1=CC=C(C=C1)F)N=C=O

InChI

InChI=1S/C11H10FNO3/c1-16-11(15)6-10(13-7-14)8-2-4-9(12)5-3-8/h2-5,10H,6H2,1H3/t10-/m0/s1