4-methyl-2,6-dinitro-N3,5-bis(prop-2-enyl)benzene-1,3-diamine

Systemtic Name: 4-methyl-2,6-dinitro-N3,5-bis(prop-2-enyl)benzene-1,3-diamine Openeye Name: N3,5-diallyl-4-methyl-2,6-dinitro-benzene-1,3-diamine CAS Name: 4-methyl-2,6-dinitro-N3,5-bis(prop-2-enyl)benzene-1,3-diamine IUPAC Name: 4-methyl-2,6-dinitro-3-N,5-bis(prop-2-enyl)benzene-1,3-diamine Traditional Name: allyl-(3-allyl-5-amino-2-methyl-4,6-dinitro-phenyl)amine Formula: C13H16N4O4 MolecularWeight: 292.29054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1NCC=C)[N+](=O)[O-])N)[N+](=O)[O-])CC=C

Isomeric SMILES

CC1=C(C(=C(C(=C1NCC=C)[N+](=O)[O-])N)[N+](=O)[O-])CC=C

InChI

InChI=1S/C13H16N4O4/c1-4-6-9-8(3)11(15-7-5-2)13(17(20)21)10(14)12(9)16(18)19/h4-5,15H,1-2,6-7,14H2,3H3