2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-(4-chloranyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-(4-chloranyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[4-[2-(tert-butylamino)-2-oxo-ethyl]piperazin-1-yl]-N-(4-chloro-3-nitro-phenyl)acetamide CAS Name: 2-[4-[2-(tert-butylamino)-2-oxoethyl]-1-piperazinyl]-N-(4-chloro-3-nitrophenyl)acetamide IUPAC Name: 2-[4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl]-N-(4-chloro-3-nitrophenyl)acetamide Traditional Name: 2-[4-[2-(tert-butylamino)-2-keto-ethyl]piperazino]-N-(4-chloro-3-nitro-phenyl)acetamide Formula: C18H26ClN5O4 MolecularWeight: 411.88314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCN(CC1)CC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCN(CC1)CC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H26ClN5O4/c1-18(2,3)21-17(26)12-23-8-6-22(7-9-23)11-16(25)20-13-4-5-14(19)15(10-13)24(27)28/h4-5,10H,6-9,11-12H2,1-3H3,(H,20,25)(H,21,26)