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

Systemtic Name: N-heptan-2-yl-2-methyl-3-nitro-benzamide Openeye Name: 2-methyl-N-(1-methylhexyl)-3-nitro-benzamide CAS Name: N-heptan-2-yl-2-methyl-3-nitrobenzamide IUPAC Name: N-heptan-2-yl-2-methyl-3-nitrobenzamide Traditional Name: 2-methyl-N-(1-methylhexyl)-3-nitro-benzamide Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3/c1-4-5-6-8-11(2)16-15(18)13-9-7-10-14(12(13)3)17(19)20/h7,9-11H,4-6,8H2,1-3H3,(H,16,18)