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

Systemtic Name: 4-chloranyl-N-[(2S)-1-(2,2-dimethylhydrazinyl)-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S)-2-(2,2-dimethylhydrazino)-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-1-(2,2-dimethylhydrazinyl)-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-1-(2,2-dimethylhydrazinyl)-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S)-2-(N',N'-dimethylhydrazino)-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C12H15ClN4O4 MolecularWeight: 314.7249

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN(C)C)NC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClN4O4/c1-7(11(18)15-16(2)3)14-12(19)8-4-5-9(13)10(6-8)17(20)21/h4-7H,1-3H3,(H,14,19)(H,15,18)/t7-/m0/s1