methyl 2-[3-(4-isocyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]ethanoate

Systemtic Name: methyl 2-[3-(4-isocyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]ethanoate Openeye Name: methyl 2-[3-(4-isocyanophenyl)-4,5-dihydroisoxazol-5-yl]acetate CAS Name: 2-[3-(4-isocyanophenyl)-4,5-dihydroisoxazol-5-yl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(4-isocyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetate Traditional Name: 2-[3-(4-isocyanophenyl)-2-isoxazolin-5-yl]acetic acid methyl ester Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC(=NO1)C2=CC=C(C=C2)[N+]#[C-]

Isomeric SMILES

COC(=O)CC1CC(=NO1)C2=CC=C(C=C2)[N+]#[C-]

InChI

InChI=1S/C13H12N2O3/c1-14-10-5-3-9(4-6-10)12-7-11(18-15-12)8-13(16)17-2/h3-6,11H,7-8H2,2H3