methyl 2-(2-chloranyl-4-isocyano-5-methyl-phenyl)ethanoate

Systemtic Name: methyl 2-(2-chloranyl-4-isocyano-5-methyl-phenyl)ethanoate Openeye Name: methyl 2-(2-chloro-4-isocyano-5-methyl-phenyl)acetate CAS Name: 2-(2-chloro-4-isocyano-5-methylphenyl)acetic acid methyl ester IUPAC Name: methyl 2-(2-chloro-4-isocyano-5-methylphenyl)acetate Traditional Name: 2-(2-chloro-4-isocyano-5-methyl-phenyl)acetic acid methyl ester Formula: C11H10ClNO2 MolecularWeight: 223.6556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1[N+]#[C-])Cl)CC(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1[N+]#[C-])Cl)CC(=O)OC

InChI

InChI=1S/C11H10ClNO2/c1-7-4-8(5-11(14)15-3)9(12)6-10(7)13-2/h4,6H,5H2,1,3H3