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

Systemtic Name: N-butyl-4-methyl-N-[2-[2-(4-methylphenyl)-3-oxidanylidene-5-propan-2-yl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-butyl-N-[2-[5-isopropyl-3-oxo-2-(p-tolyl)-1H-pyrazol-4-yl]-2-oxo-ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-butyl-4-methyl-N-[2-[2-(4-methylphenyl)-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-butyl-4-methyl-N-[2-[2-(4-methylphenyl)-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-butyl-N-[2-[3-isopropyl-5-keto-1-(p-tolyl)-3-pyrazolin-4-yl]-2-keto-ethyl]-4-methyl-3-nitro-benzamide Formula: C27H32N4O5 MolecularWeight: 492.56678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H32N4O5/c1-6-7-14-29(26(33)20-11-10-19(5)22(15-20)31(35)36)16-23(32)24-25(17(2)3)28-30(27(24)34)21-12-8-18(4)9-13-21/h8-13,15,17,28H,6-7,14,16H2,1-5H3