N-(4-butan-2-ylphenyl)-3-nitro-benzamide

Systemtic Name: N-(4-butan-2-ylphenyl)-3-nitro-benzamide Openeye Name: 3-nitro-N-(4-sec-butylphenyl)benzamide CAS Name: N-(4-butan-2-ylphenyl)-3-nitrobenzamide IUPAC Name: N-(4-butan-2-ylphenyl)-3-nitrobenzamide Traditional Name: 3-nitro-N-(4-sec-butylphenyl)benzamide Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O3/c1-3-12(2)13-7-9-15(10-8-13)18-17(20)14-5-4-6-16(11-14)19(21)22/h4-12H,3H2,1-2H3,(H,18,20)