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

Systemtic Name: N-[(2S)-1-[(2-chloranyl-4-nitro-phenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]benzamide Openeye Name: N-[(1S)-1-benzyl-2-(2-chloro-4-nitro-anilino)-2-oxo-ethyl]benzamide CAS Name: N-[(2S)-1-(2-chloro-4-nitroanilino)-1-oxo-3-phenylpropan-2-yl]benzamide IUPAC Name: N-[(2S)-1-(2-chloro-4-nitroanilino)-1-oxo-3-phenylpropan-2-yl]benzamide Traditional Name: N-[(1S)-1-benzyl-2-(2-chloro-4-nitro-anilino)-2-keto-ethyl]benzamide Formula: C22H18ClN3O4 MolecularWeight: 423.84902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H18ClN3O4/c23-18-14-17(26(29)30)11-12-19(18)24-22(28)20(13-15-7-3-1-4-8-15)25-21(27)16-9-5-2-6-10-16/h1-12,14,20H,13H2,(H,24,28)(H,25,27)/t20-/m0/s1