4-[[(2S)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-nitro-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[(2S)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-nitro-4-oxidanylidene-butanoic acid Openeye Name: 4-[[(1S)-1-benzyl-2-methoxy-2-oxo-ethyl]amino]-3-nitro-4-oxo-butanoic acid CAS Name: 4-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-3-nitro-4-oxobutanoic acid IUPAC Name: 4-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-3-nitro-4-oxobutanoic acid Traditional Name: 4-[[(1S)-1-benzyl-2-keto-2-methoxy-ethyl]amino]-4-keto-3-nitro-butyric acid Formula: C14H16N2O7 MolecularWeight: 324.28604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C(CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O7/c1-23-14(20)10(7-9-5-3-2-4-6-9)15-13(19)11(16(21)22)8-12(17)18/h2-6,10-11H,7-8H2,1H3,(H,15,19)(H,17,18)/t10-,11?/m0/s1