4-[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]oxybenzoate

Systemtic Name: 4-[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]oxybenzoate Openeye Name: 4-[(1S)-2-(cyclopropylamino)-1-methyl-2-oxo-ethoxy]benzoate CAS Name: 4-[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]oxybenzoate IUPAC Name: 4-[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]oxybenzoate Traditional Name: 4-[(1S)-2-(cyclopropylamino)-2-keto-1-methyl-ethoxy]benzoate Formula: C13H14NO4- MolecularWeight: 248.25456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NC1CC1)OC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C13H15NO4/c1-8(12(15)14-10-4-5-10)18-11-6-2-9(3-7-11)13(16)17/h2-3,6-8,10H,4-5H2,1H3,(H,14,15)(H,16,17)/p-1/t8-/m0/s1