N-heptan-2-yl-2-methoxy-5-nitro-benzamide

Systemtic Name: N-heptan-2-yl-2-methoxy-5-nitro-benzamide Openeye Name: 2-methoxy-N-(1-methylhexyl)-5-nitro-benzamide CAS Name: N-heptan-2-yl-2-methoxy-5-nitrobenzamide IUPAC Name: N-heptan-2-yl-2-methoxy-5-nitrobenzamide Traditional Name: 2-methoxy-N-(1-methylhexyl)-5-nitro-benzamide Formula: C15H22N2O4 MolecularWeight: 294.34618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O4/c1-4-5-6-7-11(2)16-15(18)13-10-12(17(19)20)8-9-14(13)21-3/h8-11H,4-7H2,1-3H3,(H,16,18)