N-[(E)-butan-2-ylideneamino]-2-(2,4-dinitrophenyl)ethanamide

Systemtic Name: N-[(E)-butan-2-ylideneamino]-2-(2,4-dinitrophenyl)ethanamide Openeye Name: 2-(2,4-dinitrophenyl)-N-[(E)-1-methylpropylideneamino]acetamide CAS Name: N-[(E)-butan-2-ylideneamino]-2-(2,4-dinitrophenyl)acetamide IUPAC Name: N-[(E)-butan-2-ylideneamino]-2-(2,4-dinitrophenyl)acetamide Traditional Name: 2-(2,4-dinitrophenyl)-N-[(E)-1-methylpropylideneamino]acetamide Formula: C12H14N4O5 MolecularWeight: 294.26336

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)CC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC/C(=N/NC(=O)CC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C

InChI

InChI=1S/C12H14N4O5/c1-3-8(2)13-14-12(17)6-9-4-5-10(15(18)19)7-11(9)16(20)21/h4-5,7H,3,6H2,1-2H3,(H,14,17)/b13-8+