N-butyl-3-methoxy-4-methyl-2,6-dinitro-aniline

Systemtic Name: N-butyl-3-methoxy-4-methyl-2,6-dinitro-aniline Openeye Name: N-butyl-3-methoxy-4-methyl-2,6-dinitro-aniline CAS Name: N-butyl-3-methoxy-4-methyl-2,6-dinitroaniline IUPAC Name: N-butyl-3-methoxy-4-methyl-2,6-dinitroaniline Traditional Name: butyl-(3-methoxy-4-methyl-2,6-dinitro-phenyl)amine Formula: C12H17N3O5 MolecularWeight: 283.28048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C(=C1[N+](=O)[O-])OC)C)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C=C(C(=C1[N+](=O)[O-])OC)C)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O5/c1-4-5-6-13-10-9(14(16)17)7-8(2)12(20-3)11(10)15(18)19/h7,13H,4-6H2,1-3H3