N-(2-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine

Systemtic Name: N-(2-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine Openeye Name: 2,5-dinitro-N-(o-tolyl)benzofuran-3-amine CAS Name: N-(2-methylphenyl)-2,5-dinitro-3-benzofuranamine IUPAC Name: N-(2-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine Traditional Name: (2,5-dinitrobenzofuran-3-yl)-(o-tolyl)amine Formula: C15H11N3O5 MolecularWeight: 313.26494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=C(OC3=C2C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC2=C(OC3=C2C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O5/c1-9-4-2-3-5-12(9)16-14-11-8-10(17(19)20)6-7-13(11)23-15(14)18(21)22/h2-8,16H,1H3