methyl 4-[(3-chloranylpropanoylamino)methyl]benzoate

Systemtic Name: methyl 4-[(3-chloranylpropanoylamino)methyl]benzoate Openeye Name: methyl 4-[(3-chloropropanoylamino)methyl]benzoate CAS Name: 4-[[(3-chloro-1-oxopropyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-chloropropanoylamino)methyl]benzoate Traditional Name: 4-[(3-chloropropanoylamino)methyl]benzoic acid methyl ester Formula: C12H14ClNO3 MolecularWeight: 255.69746

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CCCl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CCCl

InChI

InChI=1S/C12H14ClNO3/c1-17-12(16)10-4-2-9(3-5-10)8-14-11(15)6-7-13/h2-5H,6-8H2,1H3,(H,14,15)