N-[(2S)-1-(2-cyclohexylcarbonylhydrazinyl)-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(2S)-1-(2-cyclohexylcarbonylhydrazinyl)-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: N-[(1S)-2-[2-(cyclohexanecarbonyl)hydrazino]-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[(2S)-1-[[cyclohexyl(oxo)methyl]hydrazo]-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: N-[(2S)-1-[2-(cyclohexanecarbonyl)hydrazinyl]-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: N-[(1S)-2-[N'-(cyclohexanecarbonyl)hydrazino]-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C17H22N4O5 MolecularWeight: 362.38038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=O)C1CCCCC1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NNC(=O)C1CCCCC1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O5/c1-11(15(22)19-20-17(24)12-6-3-2-4-7-12)18-16(23)13-8-5-9-14(10-13)21(25)26/h5,8-12H,2-4,6-7H2,1H3,(H,18,23)(H,19,22)(H,20,24)/t11-/m0/s1