methyl 4-[(5-chloranylpentanoylamino)methyl]benzoate

Systemtic Name: methyl 4-[(5-chloranylpentanoylamino)methyl]benzoate Openeye Name: methyl 4-[(5-chloropentanoylamino)methyl]benzoate CAS Name: 4-[[(5-chloro-1-oxopentyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-chloropentanoylamino)methyl]benzoate Traditional Name: 4-[(5-chloropentanoylamino)methyl]benzoic acid methyl ester Formula: C14H18ClNO3 MolecularWeight: 283.75062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18ClNO3/c1-19-14(18)12-7-5-11(6-8-12)10-16-13(17)4-2-3-9-15/h5-8H,2-4,9-10H2,1H3,(H,16,17)