N-butyl-N-[2-[[2-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-nitro-benzamide

Systemtic Name: N-butyl-N-[2-[[2-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-4-nitro-benzamide Openeye Name: N-butyl-N-[2-[[2-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-butyl-N-[2-[[2-(4-methoxyphenyl)-5-methyl-4-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-4-nitrobenzamide IUPAC Name: N-butyl-N-[2-[[2-(4-methoxyphenyl)-5-methyl-4-phenylpyrazol-3-yl]amino]-2-oxoethyl]-4-nitrobenzamide Traditional Name: N-butyl-N-[2-keto-2-[[2-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrazol-3-yl]amino]ethyl]-4-nitro-benzamide Formula: C30H31N5O5 MolecularWeight: 541.59764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=C(C(=NN1C2=CC=C(C=C2)OC)C)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)NC1=C(C(=NN1C2=CC=C(C=C2)OC)C)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C30H31N5O5/c1-4-5-19-33(30(37)23-11-13-25(14-12-23)35(38)39)20-27(36)31-29-28(22-9-7-6-8-10-22)21(2)32-34(29)24-15-17-26(40-3)18-16-24/h6-18H,4-5,19-20H2,1-3H3,(H,31,36)