N-butan-2-yl-2-[4-(2,4-dinitrophenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-butan-2-yl-2-[4-(2,4-dinitrophenyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(2,4-dinitrophenyl)piperazin-1-yl]-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-[4-(2,4-dinitrophenyl)-1-piperazinyl]acetamide IUPAC Name: N-butan-2-yl-2-[4-(2,4-dinitrophenyl)piperazin-1-yl]acetamide Traditional Name: 2-[4-(2,4-dinitrophenyl)piperazino]-N-sec-butyl-acetamide Formula: C16H23N5O5 MolecularWeight: 365.38432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC(=O)CN1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H23N5O5/c1-3-12(2)17-16(22)11-18-6-8-19(9-7-18)14-5-4-13(20(23)24)10-15(14)21(25)26/h4-5,10,12H,3,6-9,11H2,1-2H3,(H,17,22)