4-chloranyl-N-[(2S)-1-[2-(2,5-dimethylfuran-3-yl)carbonylhydrazinyl]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-1-[2-(2,5-dimethylfuran-3-yl)carbonylhydrazinyl]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S)-2-[2-(2,5-dimethylfuran-3-carbonyl)hydrazino]-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-1-[[(2,5-dimethyl-3-furanyl)-oxomethyl]hydrazo]-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-1-[2-(2,5-dimethylfuran-3-carbonyl)hydrazinyl]-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S)-2-[N'-(2,5-dimethyl-3-furoyl)hydrazino]-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C17H17ClN4O6 MolecularWeight: 408.79308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)NNC(=O)C(C)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)NNC(=O)[C@H](C)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN4O6/c1-8-6-12(10(3)28-8)17(25)21-20-15(23)9(2)19-16(24)11-4-5-13(18)14(7-11)22(26)27/h4-7,9H,1-3H3,(H,19,24)(H,20,23)(H,21,25)/t9-/m0/s1