4-(2-chloranylethanoylamino)butyl benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCCCNC(=O)CCl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCCCNC(=O)CCl

InChI

InChI=1S/C13H16ClNO3/c14-10-12(16)15-8-4-5-9-18-13(17)11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,(H,15,16)