N-butyl-N-[2-[2-(2-methylphenyl)-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-butyl-N-[2-[2-(2-methylphenyl)-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-butyl-3-nitro-N-[2-[2-(o-tolyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]-2-oxo-ethyl]benzamide CAS Name: N-butyl-N-[2-[2-(2-methylphenyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-butyl-N-[2-[2-(2-methylphenyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-butyl-N-[2-keto-2-[5-keto-1-(o-tolyl)-3-phenyl-3-pyrazolin-4-yl]ethyl]-3-nitro-benzamide Formula: C29H28N4O5 MolecularWeight: 512.55642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)C1=C(NN(C1=O)C2=CC=CC=C2C)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)C1=C(NN(C1=O)C2=CC=CC=C2C)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H28N4O5/c1-3-4-17-31(28(35)22-14-10-15-23(18-22)33(37)38)19-25(34)26-27(21-12-6-5-7-13-21)30-32(29(26)36)24-16-9-8-11-20(24)2/h5-16,18,30H,3-4,17,19H2,1-2H3