[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 5-bromanyl-2-chloranyl-benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C14H17BrClNO3 MolecularWeight: 362.64668

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=C(C=CC(=C1)Br)Cl

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=C(C=CC(=C1)Br)Cl

InChI

InChI=1S/C14H17BrClNO3/c1-3-10(4-2)17-13(18)8-20-14(19)11-7-9(15)5-6-12(11)16/h5-7,10H,3-4,8H2,1-2H3,(H,17,18)