N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-3-nitro-benzamide

Systemtic Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-3-nitro-benzamide Openeye Name: N-[4-[2,4-bis(1,1-dimethylpropoxy)phenyl]butyl]-3-nitro-benzamide CAS Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-3-nitrobenzamide IUPAC Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-3-nitrobenzamide Traditional Name: N-[4-(2,4-ditert-amyloxyphenyl)butyl]-3-nitro-benzamide Formula: C27H38N2O5 MolecularWeight: 470.60102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OC1=CC(=C(C=C1)CCCCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC(C)(C)CC

Isomeric SMILES

CCC(C)(C)OC1=CC(=C(C=C1)CCCCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC(C)(C)CC

InChI

InChI=1S/C27H38N2O5/c1-7-26(3,4)33-23-16-15-20(24(19-23)34-27(5,6)8-2)12-9-10-17-28-25(30)21-13-11-14-22(18-21)29(31)32/h11,13-16,18-19H,7-10,12,17H2,1-6H3,(H,28,30)