[1-oxidanylidene-1-(propylamino)propan-2-yl] 3-bromanyl-4-methoxy-benzoate

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] 3-bromanyl-4-methoxy-benzoate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] 3-bromo-4-methoxy-benzoate CAS Name: 3-bromo-4-methoxybenzoic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] 3-bromo-4-methoxybenzoate Traditional Name: 3-bromo-4-methoxy-benzoic acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C14H18BrNO4 MolecularWeight: 344.20102

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC(=C(C=C1)OC)Br

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)C1=CC(=C(C=C1)OC)Br

InChI

InChI=1S/C14H18BrNO4/c1-4-7-16-13(17)9(2)20-14(18)10-5-6-12(19-3)11(15)8-10/h5-6,8-9H,4,7H2,1-3H3,(H,16,17)