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

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 4-bromanyl-3,5-dimethoxy-benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 4-bromo-3,5-dimethoxy-benzoate CAS Name: 4-bromo-3,5-dimethoxybenzoic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 4-bromo-3,5-dimethoxybenzoate Traditional Name: 4-bromo-3,5-dimethoxy-benzoic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C15H20BrNO5 MolecularWeight: 374.227

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20BrNO5/c1-5-6-17-14(18)9(2)22-15(19)10-7-11(20-3)13(16)12(8-10)21-4/h7-9H,5-6H2,1-4H3,(H,17,18)/t9-/m0/s1