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

Systemtic Name: 3,5-dimethyl-4-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]oxy-benzoate Openeye Name: 3,5-dimethyl-4-[(1S)-1-methyl-2-oxo-2-(propylamino)ethoxy]benzoate CAS Name: 3,5-dimethyl-4-[(2S)-1-oxo-1-(propylamino)propan-2-yl]oxybenzoate IUPAC Name: 3,5-dimethyl-4-[(2S)-1-oxo-1-(propylamino)propan-2-yl]oxybenzoate Traditional Name: 4-[(1S)-2-keto-1-methyl-2-(propylamino)ethoxy]-3,5-dimethyl-benzoate Formula: C15H20NO4- MolecularWeight: 278.3236

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC1=C(C=C(C=C1C)C(=O)[O-])C

Isomeric SMILES

CCCNC(=O)[C@H](C)OC1=C(C=C(C=C1C)C(=O)[O-])C

InChI

InChI=1S/C15H21NO4/c1-5-6-16-14(17)11(4)20-13-9(2)7-12(15(18)19)8-10(13)3/h7-8,11H,5-6H2,1-4H3,(H,16,17)(H,18,19)/p-1/t11-/m0/s1