2-[2-cyanoethyl(methyl)amino]-N-(2,4-dinitrophenyl)ethanamide

Systemtic Name: 2-[2-cyanoethyl(methyl)amino]-N-(2,4-dinitrophenyl)ethanamide Openeye Name: 2-[2-cyanoethyl(methyl)amino]-N-(2,4-dinitrophenyl)acetamide CAS Name: 2-[2-cyanoethyl(methyl)amino]-N-(2,4-dinitrophenyl)acetamide IUPAC Name: 2-[2-cyanoethyl(methyl)amino]-N-(2,4-dinitrophenyl)acetamide Traditional Name: 2-[2-cyanoethyl(methyl)amino]-N-(2,4-dinitrophenyl)acetamide Formula: C12H13N5O5 MolecularWeight: 307.26212

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)CC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(CCC#N)CC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O5/c1-15(6-2-5-13)8-12(18)14-10-4-3-9(16(19)20)7-11(10)17(21)22/h3-4,7H,2,6,8H2,1H3,(H,14,18)