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

Systemtic Name: 3-nitro-N-[(2S)-1-oxidanylidene-1-[[2-(phenylmethyl)phenyl]amino]propan-2-yl]benzamide Openeye Name: N-[(1S)-2-(2-benzylanilino)-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 3-nitro-N-[(2S)-1-oxo-1-[2-(phenylmethyl)anilino]propan-2-yl]benzamide IUPAC Name: N-[(2S)-1-(2-benzylanilino)-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: N-[(1S)-2-(2-benzylanilino)-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1CC2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1CC2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O4/c1-16(24-23(28)19-11-7-12-20(15-19)26(29)30)22(27)25-21-13-6-5-10-18(21)14-17-8-3-2-4-9-17/h2-13,15-16H,14H2,1H3,(H,24,28)(H,25,27)/t16-/m0/s1