5-[(2-chloranylethanoylamino)methyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[(2-chloranylethanoylamino)methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[(2-chloroacetyl)amino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[(2-chloro-1-oxoethyl)amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[(2-chloroacetyl)amino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[(2-chloroacetyl)amino]methyl]-2-methoxy-benzoic acid Formula: C11H12ClNO4 MolecularWeight: 257.67028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CCl)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CCl)C(=O)O

InChI

InChI=1S/C11H12ClNO4/c1-17-9-3-2-7(4-8(9)11(15)16)6-13-10(14)5-12/h2-4H,5-6H2,1H3,(H,13,14)(H,15,16)