methyl 4-[methyl-(2-oxidanyl-3-oxidanylidene-butyl)amino]benzoate

Systemtic Name: methyl 4-[methyl-(2-oxidanyl-3-oxidanylidene-butyl)amino]benzoate Openeye Name: methyl 4-[(2-hydroxy-3-oxo-butyl)-methyl-amino]benzoate CAS Name: 4-[(2-hydroxy-3-oxobutyl)-methylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-hydroxy-3-oxobutyl)-methylamino]benzoate Traditional Name: 4-[(2-hydroxy-3-keto-butyl)-methyl-amino]benzoic acid methyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CN(C)C1=CC=C(C=C1)C(=O)OC)O

Isomeric SMILES

CC(=O)C(CN(C)C1=CC=C(C=C1)C(=O)OC)O

InChI

InChI=1S/C13H17NO4/c1-9(15)12(16)8-14(2)11-6-4-10(5-7-11)13(17)18-3/h4-7,12,16H,8H2,1-3H3