[(2S)-2-isocyano-3-(4-methoxyphenyl)propyl] ethanoate

Systemtic Name: [(2S)-2-isocyano-3-(4-methoxyphenyl)propyl] ethanoate Openeye Name: [(2S)-2-isocyano-3-(4-methoxyphenyl)propyl] acetate CAS Name: acetic acid [(2S)-2-isocyano-3-(4-methoxyphenyl)propyl] ester IUPAC Name: [(2S)-2-isocyano-3-(4-methoxyphenyl)propyl] acetate Traditional Name: acetic acid [(2S)-2-isocyano-3-(4-methoxyphenyl)propyl] ester Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CC1=CC=C(C=C1)OC)[N+]#[C-]

Isomeric SMILES

CC(=O)OC[C@H](CC1=CC=C(C=C1)OC)[N+]#[C-]

InChI

InChI=1S/C13H15NO3/c1-10(15)17-9-12(14-2)8-11-4-6-13(16-3)7-5-11/h4-7,12H,8-9H2,1,3H3/t12-/m0/s1