N-butyl-2-[4-[1-(4-nitrophenyl)pyrazol-4-yl]carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[1-(4-nitrophenyl)pyrazol-4-yl]carbonylpiperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[1-(4-nitrophenyl)pyrazole-4-carbonyl]piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[[1-(4-nitrophenyl)-4-pyrazolyl]-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-[1-(4-nitrophenyl)pyrazole-4-carbonyl]piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-[1-(4-nitrophenyl)pyrazole-4-carbonyl]piperazino]acetamide Formula: C20H26N6O4 MolecularWeight: 414.45824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H26N6O4/c1-2-3-8-21-19(27)15-23-9-11-24(12-10-23)20(28)16-13-22-25(14-16)17-4-6-18(7-5-17)26(29)30/h4-7,13-14H,2-3,8-12,15H2,1H3,(H,21,27)