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

Systemtic Name: N-butyl-2-[4-(3-methyl-2-nitro-phenyl)carbonylpiperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-(3-methyl-2-nitro-benzoyl)piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[(3-methyl-2-nitrophenyl)-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-(3-methyl-2-nitrobenzoyl)piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-(3-methyl-2-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=C(C(=CC=C2)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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