4-nitro-N-(3-propylhexan-2-yl)benzamide

Systemtic Name: 4-nitro-N-(3-propylhexan-2-yl)benzamide Openeye Name: N-(1-methyl-2-propyl-pentyl)-4-nitro-benzamide CAS Name: 4-nitro-N-(3-propylhexan-2-yl)benzamide IUPAC Name: 4-nitro-N-(3-propylhexan-2-yl)benzamide Traditional Name: N-(1-methyl-2-propyl-pentyl)-4-nitro-benzamide Formula: C16H24N2O3 MolecularWeight: 292.37336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O3/c1-4-6-13(7-5-2)12(3)17-16(19)14-8-10-15(11-9-14)18(20)21/h8-13H,4-7H2,1-3H3,(H,17,19)