N-[(2S)-1-[[(2S)-1-(4-nitrophenyl)-3-oxidanyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]benzamide

Systemtic Name: N-[(2S)-1-[[(2S)-1-(4-nitrophenyl)-3-oxidanyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]benzamide Openeye Name: N-[(1S)-1-benzyl-2-[[(1S)-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]amino]-2-oxo-ethyl]benzamide CAS Name: N-[(2S)-1-[[(2S)-1-hydroxy-3-(4-nitrophenyl)propan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]benzamide IUPAC Name: N-[(2S)-1-[[(2S)-1-hydroxy-3-(4-nitrophenyl)propan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]benzamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-[[(1S)-1-methylol-2-(4-nitrophenyl)ethyl]amino]ethyl]benzamide Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CC2=CC=C(C=C2)[N+](=O)[O-])CO)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CC2=CC=C(C=C2)[N+](=O)[O-])CO)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H25N3O5/c29-17-21(15-19-11-13-22(14-12-19)28(32)33)26-25(31)23(16-18-7-3-1-4-8-18)27-24(30)20-9-5-2-6-10-20/h1-14,21,23,29H,15-17H2,(H,26,31)(H,27,30)/t21-,23-/m0/s1