methyl 5-ethoxy-2-isocyanato-benzoate

Systemtic Name: methyl 5-ethoxy-2-isocyanato-benzoate Openeye Name: methyl 5-ethoxy-2-isocyanato-benzoate CAS Name: 5-ethoxy-2-isocyanatobenzoic acid methyl ester IUPAC Name: methyl 5-ethoxy-2-isocyanatobenzoate Traditional Name: 5-ethoxy-2-isocyanato-benzoic acid methyl ester Formula: C11H11NO4 MolecularWeight: 221.20934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)N=C=O)C(=O)OC

Isomeric SMILES

CCOC1=CC(=C(C=C1)N=C=O)C(=O)OC

InChI

InChI=1S/C11H11NO4/c1-3-16-8-4-5-10(12-7-13)9(6-8)11(14)15-2/h4-6H,3H2,1-2H3