N-butyl-2-[4-(4-methyl-3-nitro-phenyl)carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-(4-methyl-3-nitro-phenyl)carbonylpiperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-(4-methyl-3-nitro-benzoyl)piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[(4-methyl-3-nitrophenyl)-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-(4-methyl-3-nitrobenzoyl)piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-(4-methyl-3-nitro-benzoyl)piperazino]acetamide Formula: C18H26N4O4 MolecularWeight: 362.42344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C18H26N4O4/c1-3-4-7-19-17(23)13-20-8-10-21(11-9-20)18(24)15-6-5-14(2)16(12-15)22(25)26/h5-6,12H,3-4,7-11,13H2,1-2H3,(H,19,23)