4-nitro-N-[[[(2S)-1-oxidanylidene-3-phenyl-1-[(phenylmethyl)amino]propan-2-yl]amino]methyl]benzamide

Systemtic Name: 4-nitro-N-[[[(2S)-1-oxidanylidene-3-phenyl-1-[(phenylmethyl)amino]propan-2-yl]amino]methyl]benzamide Openeye Name: N-[[[(1S)-1-benzyl-2-(benzylamino)-2-oxo-ethyl]amino]methyl]-4-nitro-benzamide CAS Name: 4-nitro-N-[[[(2S)-1-oxo-3-phenyl-1-[(phenylmethyl)amino]propan-2-yl]amino]methyl]benzamide IUPAC Name: N-[[[(2S)-1-(benzylamino)-1-oxo-3-phenylpropan-2-yl]amino]methyl]-4-nitrobenzamide Traditional Name: N-[[[(1S)-1-benzyl-2-(benzylamino)-2-keto-ethyl]amino]methyl]-4-nitro-benzamide Formula: C24H24N4O4 MolecularWeight: 432.47176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCC2=CC=CC=C2)NCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NCC2=CC=CC=C2)NCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H24N4O4/c29-23(20-11-13-21(14-12-20)28(31)32)27-17-26-22(15-18-7-3-1-4-8-18)24(30)25-16-19-9-5-2-6-10-19/h1-14,22,26H,15-17H2,(H,25,30)(H,27,29)/t22-/m0/s1