3-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]ethanoylamino]-N-(4-nitrophenyl)benzamide

Systemtic Name: 3-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]ethanoylamino]-N-(4-nitrophenyl)benzamide Openeye Name: 3-[[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-(4-nitrophenyl)benzamide CAS Name: 3-[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-oxoethyl]amino]-N-(4-nitrophenyl)benzamide IUPAC Name: 3-[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]acetyl]amino]-N-(4-nitrophenyl)benzamide Traditional Name: 3-[[2-(2,4-ditert-amylphenoxy)acetyl]amino]-N-(4-nitrophenyl)benzamide Formula: C31H37N3O5 MolecularWeight: 531.64258

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C(C)(C)CC

InChI

InChI=1S/C31H37N3O5/c1-7-30(3,4)22-12-17-27(26(19-22)31(5,6)8-2)39-20-28(35)32-24-11-9-10-21(18-24)29(36)33-23-13-15-25(16-14-23)34(37)38/h9-19H,7-8,20H2,1-6H3,(H,32,35)(H,33,36)