3-[(2-chloranylethanoylamino)methyl]benzoate

Systemtic Name: 3-[(2-chloranylethanoylamino)methyl]benzoate Openeye Name: 3-[[(2-chloroacetyl)amino]methyl]benzoate CAS Name: 3-[[(2-chloro-1-oxoethyl)amino]methyl]benzoate IUPAC Name: 3-[[(2-chloroacetyl)amino]methyl]benzoate Traditional Name: 3-[[(2-chloroacetyl)amino]methyl]benzoate Formula: C10H9ClNO3- MolecularWeight: 226.63636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CNC(=O)CCl)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)CNC(=O)CCl)C(=O)[O-]

InChI

InChI=1S/C10H10ClNO3/c11-5-9(13)12-6-7-2-1-3-8(4-7)10(14)15/h1-4H,5-6H2,(H,12,13)(H,14,15)/p-1