3-[(3-azanyl-2-nitro-phenyl)methyl]-2-nitro-aniline

Systemtic Name: 3-[(3-azanyl-2-nitro-phenyl)methyl]-2-nitro-aniline Openeye Name: 3-[(3-amino-2-nitro-phenyl)methyl]-2-nitro-aniline CAS Name: 3-[(3-amino-2-nitrophenyl)methyl]-2-nitroaniline IUPAC Name: 3-[(3-amino-2-nitrophenyl)methyl]-2-nitroaniline Traditional Name: [3-(3-amino-2-nitro-benzyl)-2-nitro-phenyl]amine Formula: C13H12N4O4 MolecularWeight: 288.25878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)N)[N+](=O)[O-])CC2=C(C(=CC=C2)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)N)[N+](=O)[O-])CC2=C(C(=CC=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O4/c14-10-5-1-3-8(12(10)16(18)19)7-9-4-2-6-11(15)13(9)17(20)21/h1-6H,7,14-15H2