methyl 3-(3-cyanophenyl)-2-isocyanato-propanoate

Systemtic Name: methyl 3-(3-cyanophenyl)-2-isocyanato-propanoate Openeye Name: methyl 3-(3-cyanophenyl)-2-isocyanato-propanoate CAS Name: 3-(3-cyanophenyl)-2-isocyanatopropanoic acid methyl ester IUPAC Name: methyl 3-(3-cyanophenyl)-2-isocyanatopropanoate Traditional Name: 3-(3-cyanophenyl)-2-isocyanato-propionic acid methyl ester Formula: C12H10N2O3 MolecularWeight: 230.2194

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC(=C1)C#N)N=C=O

Isomeric SMILES

COC(=O)C(CC1=CC=CC(=C1)C#N)N=C=O

InChI

InChI=1S/C12H10N2O3/c1-17-12(16)11(14-8-15)6-9-3-2-4-10(5-9)7-13/h2-5,11H,6H2,1H3