ethyl 3-[(2-chloranylethanoylamino)methyl]-4-methyl-benzoate

Systemtic Name: ethyl 3-[(2-chloranylethanoylamino)methyl]-4-methyl-benzoate Openeye Name: ethyl 3-[[(2-chloroacetyl)amino]methyl]-4-methyl-benzoate CAS Name: 3-[[(2-chloro-1-oxoethyl)amino]methyl]-4-methylbenzoic acid ethyl ester IUPAC Name: ethyl 3-[[(2-chloroacetyl)amino]methyl]-4-methylbenzoate Traditional Name: 3-[[(2-chloroacetyl)amino]methyl]-4-methyl-benzoic acid ethyl ester Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C)CNC(=O)CCl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C)CNC(=O)CCl

InChI

InChI=1S/C13H16ClNO3/c1-3-18-13(17)10-5-4-9(2)11(6-10)8-15-12(16)7-14/h4-6H,3,7-8H2,1-2H3,(H,15,16)