2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[2-oxidanylidene-2-(propylamino)ethyl]ethanamide

Systemtic Name: 2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[2-oxidanylidene-2-(propylamino)ethyl]ethanamide Openeye Name: 2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[2-oxo-2-(propylamino)ethyl]acetamide CAS Name: 2-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-N-[2-oxo-2-(propylamino)ethyl]acetamide IUPAC Name: 2-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]-N-[2-oxo-2-(propylamino)ethyl]acetamide Traditional Name: N-[2-keto-2-(propylamino)ethyl]-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetamide Formula: C22H23N5O4 MolecularWeight: 421.44912

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=O)CC1=CN(N=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)CNC(=O)CC1=CN(N=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C22H23N5O4/c1-2-12-23-21(29)14-24-20(28)13-17-15-26(18-6-4-3-5-7-18)25-22(17)16-8-10-19(11-9-16)27(30)31/h3-11,15H,2,12-14H2,1H3,(H,23,29)(H,24,28)