N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-5-nitro-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-5-nitro-2-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-5-nitro-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-5-nitro-2-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-5-nitro-2-pyrrolidino-benzamide Formula: C17H24N4O4 MolecularWeight: 348.39686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2CCCC2

Isomeric SMILES

CC(C)(C)NC(=O)CNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2CCCC2

InChI

InChI=1S/C17H24N4O4/c1-17(2,3)19-15(22)11-18-16(23)13-10-12(21(24)25)6-7-14(13)20-8-4-5-9-20/h6-7,10H,4-5,8-9,11H2,1-3H3,(H,18,23)(H,19,22)