4-butan-2-yl-5-nitro-2-oxidanyl-3-phenyl-benzamide

Systemtic Name: 4-butan-2-yl-5-nitro-2-oxidanyl-3-phenyl-benzamide Openeye Name: 2-hydroxy-5-nitro-3-phenyl-4-sec-butyl-benzamide CAS Name: 4-butan-2-yl-2-hydroxy-5-nitro-3-phenylbenzamide IUPAC Name: 4-butan-2-yl-2-hydroxy-5-nitro-3-phenylbenzamide Traditional Name: 2-hydroxy-5-nitro-3-phenyl-4-sec-butyl-benzamide Formula: C17H18N2O4 MolecularWeight: 314.33582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C=C(C(=C1C2=CC=CC=C2)O)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=C(C=C(C(=C1C2=CC=CC=C2)O)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4/c1-3-10(2)14-13(19(22)23)9-12(17(18)21)16(20)15(14)11-7-5-4-6-8-11/h4-10,20H,3H2,1-2H3,(H2,18,21)