N-(4-methoxybutan-2-yl)-3,4-dimethyl-2,6-dinitro-aniline

Systemtic Name: N-(4-methoxybutan-2-yl)-3,4-dimethyl-2,6-dinitro-aniline Openeye Name: N-(3-methoxy-1-methyl-propyl)-3,4-dimethyl-2,6-dinitro-aniline CAS Name: N-(4-methoxybutan-2-yl)-3,4-dimethyl-2,6-dinitroaniline IUPAC Name: N-(4-methoxybutan-2-yl)-3,4-dimethyl-2,6-dinitroaniline Traditional Name: (3,4-dimethyl-2,6-dinitro-phenyl)-(3-methoxy-1-methyl-propyl)amine Formula: C13H19N3O5 MolecularWeight: 297.30706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)[N+](=O)[O-])NC(C)CCOC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1C)[N+](=O)[O-])NC(C)CCOC)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O5/c1-8-7-11(15(17)18)12(13(10(8)3)16(19)20)14-9(2)5-6-21-4/h7,9,14H,5-6H2,1-4H3