N-[(2S)-3-methyl-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]-2-phenyl-ethanamide

Systemtic Name: N-[(2S)-3-methyl-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]-2-phenyl-ethanamide Openeye Name: N-[(1S)-2-methyl-1-[4-(4-nitrophenyl)piperazine-1-carbonyl]propyl]-2-phenyl-acetamide CAS Name: N-[(2S)-3-methyl-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-oxobutan-2-yl]-2-phenylacetamide IUPAC Name: N-[(2S)-3-methyl-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxobutan-2-yl]-2-phenylacetamide Traditional Name: N-[(1S)-2-methyl-1-[4-(4-nitrophenyl)piperazine-1-carbonyl]propyl]-2-phenyl-acetamide Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H28N4O4/c1-17(2)22(24-21(28)16-18-6-4-3-5-7-18)23(29)26-14-12-25(13-15-26)19-8-10-20(11-9-19)27(30)31/h3-11,17,22H,12-16H2,1-2H3,(H,24,28)/t22-/m0/s1