4-methyl-N-(2-methylpropyl)-3-nitro-benzamide

Systemtic Name: 4-methyl-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: N-isobutyl-4-methyl-3-nitro-benzamide CAS Name: 4-methyl-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: 4-methyl-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: N-isobutyl-4-methyl-3-nitro-benzamide Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O3/c1-8(2)7-13-12(15)10-5-4-9(3)11(6-10)14(16)17/h4-6,8H,7H2,1-3H3,(H,13,15)