N-heptan-2-yl-3,4,5-trimethoxy-2-nitro-benzamide

Systemtic Name: N-heptan-2-yl-3,4,5-trimethoxy-2-nitro-benzamide Openeye Name: 3,4,5-trimethoxy-N-(1-methylhexyl)-2-nitro-benzamide CAS Name: N-heptan-2-yl-3,4,5-trimethoxy-2-nitrobenzamide IUPAC Name: N-heptan-2-yl-3,4,5-trimethoxy-2-nitrobenzamide Traditional Name: 3,4,5-trimethoxy-N-(1-methylhexyl)-2-nitro-benzamide Formula: C17H26N2O6 MolecularWeight: 354.39814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O6/c1-6-7-8-9-11(2)18-17(20)12-10-13(23-3)15(24-4)16(25-5)14(12)19(21)22/h10-11H,6-9H2,1-5H3,(H,18,20)