(2R,3S)-2-[2-(4-nitrophenyl)ethanoylamino]-3-oxidanyl-3-phenyl-propanoate

Systemtic Name: (2R,3S)-2-[2-(4-nitrophenyl)ethanoylamino]-3-oxidanyl-3-phenyl-propanoate Openeye Name: (2R,3S)-3-hydroxy-2-[[2-(4-nitrophenyl)acetyl]amino]-3-phenyl-propanoate CAS Name: (2R,3S)-3-hydroxy-2-[[2-(4-nitrophenyl)-1-oxoethyl]amino]-3-phenylpropanoate IUPAC Name: (2R,3S)-3-hydroxy-2-[[2-(4-nitrophenyl)acetyl]amino]-3-phenylpropanoate Traditional Name: (2R,3S)-3-hydroxy-2-[[2-(4-nitrophenyl)acetyl]amino]-3-phenyl-propionate Formula: C17H15N2O6- MolecularWeight: 343.3108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)[O-])NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]([C@H](C(=O)[O-])NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H16N2O6/c20-14(10-11-6-8-13(9-7-11)19(24)25)18-15(17(22)23)16(21)12-4-2-1-3-5-12/h1-9,15-16,21H,10H2,(H,18,20)(H,22,23)/p-1/t15-,16+/m1/s1