[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-bromanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-bromanylbenzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C14H18BrNO3 MolecularWeight: 328.20162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrNO3/c1-3-12(4-2)16-13(17)9-19-14(18)10-5-7-11(15)8-6-10/h5-8,12H,3-4,9H2,1-2H3,(H,16,17)