[4-(isocyanatomethyl)phenyl] 3-isocyanatopropanoate

Systemtic Name: [4-(isocyanatomethyl)phenyl] 3-isocyanatopropanoate Openeye Name: [4-(isocyanatomethyl)phenyl] 3-isocyanatopropanoate CAS Name: 3-isocyanatopropanoic acid [4-(isocyanatomethyl)phenyl] ester IUPAC Name: [4-(isocyanatomethyl)phenyl] 3-isocyanatopropanoate Traditional Name: 3-isocyanatopropionic acid [4-(isocyanatomethyl)phenyl] ester Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN=C=O)OC(=O)CCN=C=O

Isomeric SMILES

C1=CC(=CC=C1CN=C=O)OC(=O)CCN=C=O

InChI

InChI=1S/C12H10N2O4/c15-8-13-6-5-12(17)18-11-3-1-10(2-4-11)7-14-9-16/h1-4H,5-7H2