4-methoxy-N-(3-methylbutyl)-3-nitro-benzamide

Systemtic Name: 4-methoxy-N-(3-methylbutyl)-3-nitro-benzamide Openeye Name: N-isopentyl-4-methoxy-3-nitro-benzamide CAS Name: 4-methoxy-N-(3-methylbutyl)-3-nitrobenzamide IUPAC Name: 4-methoxy-N-(3-methylbutyl)-3-nitrobenzamide Traditional Name: N-isoamyl-4-methoxy-3-nitro-benzamide Formula: C13H18N2O4 MolecularWeight: 266.29302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O4/c1-9(2)6-7-14-13(16)10-4-5-12(19-3)11(8-10)15(17)18/h4-5,8-9H,6-7H2,1-3H3,(H,14,16)