N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-4-(cyclopropylamino)-3-nitro-benzamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-4-(cyclopropylamino)-3-nitro-benzamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-4-(cyclopropylamino)-3-nitro-benzamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-4-(cyclopropylamino)-3-nitrobenzamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-4-(cyclopropylamino)-3-nitrobenzamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-4-(cyclopropylamino)-3-nitro-benzamide Formula: C16H22N4O4 MolecularWeight: 334.37028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CNC(=O)C1=CC(=C(C=C1)NC2CC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)CNC(=O)C1=CC(=C(C=C1)NC2CC2)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O4/c1-16(2,3)19-14(21)9-17-15(22)10-4-7-12(18-11-5-6-11)13(8-10)20(23)24/h4,7-8,11,18H,5-6,9H2,1-3H3,(H,17,22)(H,19,21)