2-methyl-3-nitro-N-pentan-2-yl-benzamide

Systemtic Name: 2-methyl-3-nitro-N-pentan-2-yl-benzamide Openeye Name: 2-methyl-N-(1-methylbutyl)-3-nitro-benzamide CAS Name: 2-methyl-3-nitro-N-pentan-2-ylbenzamide IUPAC Name: 2-methyl-3-nitro-N-pentan-2-ylbenzamide Traditional Name: 2-methyl-N-(1-methylbutyl)-3-nitro-benzamide Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O3/c1-4-6-9(2)14-13(16)11-7-5-8-12(10(11)3)15(17)18/h5,7-9H,4,6H2,1-3H3,(H,14,16)