[2-(hexylamino)-2-oxidanylidene-ethyl] 3-bromanyl-4-methoxy-benzoate

Systemtic Name: [2-(hexylamino)-2-oxidanylidene-ethyl] 3-bromanyl-4-methoxy-benzoate Openeye Name: [2-(hexylamino)-2-oxo-ethyl] 3-bromo-4-methoxy-benzoate CAS Name: 3-bromo-4-methoxybenzoic acid [2-(hexylamino)-2-oxoethyl] ester IUPAC Name: [2-(hexylamino)-2-oxoethyl] 3-bromo-4-methoxybenzoate Traditional Name: 3-bromo-4-methoxy-benzoic acid [2-(hexylamino)-2-keto-ethyl] ester Formula: C16H22BrNO4 MolecularWeight: 372.25418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)COC(=O)C1=CC(=C(C=C1)OC)Br

Isomeric SMILES

CCCCCCNC(=O)COC(=O)C1=CC(=C(C=C1)OC)Br

InChI

InChI=1S/C16H22BrNO4/c1-3-4-5-6-9-18-15(19)11-22-16(20)12-7-8-14(21-2)13(17)10-12/h7-8,10H,3-6,9,11H2,1-2H3,(H,18,19)