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

Systemtic Name: N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-3-nitro-N-propan-2-yl-benzamide Openeye Name: N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-oxo-ethyl]-N-isopropyl-3-nitro-benzamide CAS Name: N-[2-[(2,5-ditert-butyl-3-pyrazolyl)amino]-2-oxoethyl]-3-nitro-N-propan-2-ylbenzamide IUPAC Name: N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-oxoethyl]-3-nitro-N-propan-2-ylbenzamide Traditional Name: N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-keto-ethyl]-N-isopropyl-3-nitro-benzamide Formula: C23H33N5O4 MolecularWeight: 443.53922

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C23H33N5O4/c1-15(2)26(21(30)16-10-9-11-17(12-16)28(31)32)14-20(29)24-19-13-18(22(3,4)5)25-27(19)23(6,7)8/h9-13,15H,14H2,1-8H3,(H,24,29)