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

Systemtic Name: N-butyl-N-[2-[2-(4-chlorophenyl)-3-oxidanylidene-5-propan-2-yl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-4-nitro-benzamide Openeye Name: N-butyl-N-[2-[2-(4-chlorophenyl)-5-isopropyl-3-oxo-1H-pyrazol-4-yl]-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-butyl-N-[2-[2-(4-chlorophenyl)-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl]-2-oxoethyl]-4-nitrobenzamide IUPAC Name: N-butyl-N-[2-[2-(4-chlorophenyl)-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl]-2-oxoethyl]-4-nitrobenzamide Traditional Name: N-butyl-N-[2-[1-(4-chlorophenyl)-3-isopropyl-5-keto-3-pyrazolin-4-yl]-2-keto-ethyl]-4-nitro-benzamide Formula: C25H27ClN4O5 MolecularWeight: 498.95868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27ClN4O5/c1-4-5-14-28(24(32)17-6-10-20(11-7-17)30(34)35)15-21(31)22-23(16(2)3)27-29(25(22)33)19-12-8-18(26)9-13-19/h6-13,16,27H,4-5,14-15H2,1-3H3