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

Systemtic Name: 4-[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]oxy-3,5-dimethyl-benzoate Openeye Name: 4-[(1S)-2-(cyclopropylamino)-1-methyl-2-oxo-ethoxy]-3,5-dimethyl-benzoate CAS Name: 4-[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]oxy-3,5-dimethylbenzoate IUPAC Name: 4-[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]oxy-3,5-dimethylbenzoate Traditional Name: 4-[(1S)-2-(cyclopropylamino)-2-keto-1-methyl-ethoxy]-3,5-dimethyl-benzoate Formula: C15H18NO4- MolecularWeight: 276.30772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(C)C(=O)NC2CC2)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1O[C@@H](C)C(=O)NC2CC2)C)C(=O)[O-]

InChI

InChI=1S/C15H19NO4/c1-8-6-11(15(18)19)7-9(2)13(8)20-10(3)14(17)16-12-4-5-12/h6-7,10,12H,4-5H2,1-3H3,(H,16,17)(H,18,19)/p-1/t10-/m0/s1