[(2S)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] 4-bromanyl-3,5-dimethoxy-benzoate

Systemtic Name: [(2S)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] 4-bromanyl-3,5-dimethoxy-benzoate Openeye Name: [(1S)-2-(2-methoxyethylamino)-1-methyl-2-oxo-ethyl] 4-bromo-3,5-dimethoxy-benzoate CAS Name: 4-bromo-3,5-dimethoxybenzoic acid [(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] 4-bromo-3,5-dimethoxybenzoate Traditional Name: 4-bromo-3,5-dimethoxy-benzoic acid [(1S)-2-keto-2-(2-methoxyethylamino)-1-methyl-ethyl] ester Formula: C15H20BrNO6 MolecularWeight: 390.2264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NCCOC)OC(=O)C1=CC(=C(C(=C1)OC)Br)OC

InChI

InChI=1S/C15H20BrNO6/c1-9(14(18)17-5-6-20-2)23-15(19)10-7-11(21-3)13(16)12(8-10)22-4/h7-9H,5-6H2,1-4H3,(H,17,18)/t9-/m0/s1