methyl 4-isocyanato-2,6-dimethyl-benzoate

Systemtic Name: methyl 4-isocyanato-2,6-dimethyl-benzoate Openeye Name: methyl 4-isocyanato-2,6-dimethyl-benzoate CAS Name: 4-isocyanato-2,6-dimethylbenzoic acid methyl ester IUPAC Name: methyl 4-isocyanato-2,6-dimethylbenzoate Traditional Name: 4-isocyanato-2,6-dimethyl-benzoic acid methyl ester Formula: C11H11NO3 MolecularWeight: 205.20994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(=O)OC)C)N=C=O

Isomeric SMILES

CC1=CC(=CC(=C1C(=O)OC)C)N=C=O

InChI

InChI=1S/C11H11NO3/c1-7-4-9(12-6-13)5-8(2)10(7)11(14)15-3/h4-5H,1-3H3