N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-3-nitro-benzamide

Systemtic Name: N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-oxo-ethyl]-N-isobutyl-3-nitro-benzamide CAS Name: N-[2-[(2,5-ditert-butyl-3-pyrazolyl)amino]-2-oxoethyl]-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-oxoethyl]-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-keto-ethyl]-N-isobutyl-3-nitro-benzamide Formula: C24H35N5O4 MolecularWeight: 457.5658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(=O)NC1=CC(=NN1C(C)(C)C)C(C)(C)C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(CC(=O)NC1=CC(=NN1C(C)(C)C)C(C)(C)C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C24H35N5O4/c1-16(2)14-27(22(31)17-10-9-11-18(12-17)29(32)33)15-21(30)25-20-13-19(23(3,4)5)26-28(20)24(6,7)8/h9-13,16H,14-15H2,1-8H3,(H,25,30)