2-methyl-5-nitro-N-[(4-nitrophenyl)methyl]aniline

Systemtic Name: 2-methyl-5-nitro-N-[(4-nitrophenyl)methyl]aniline Openeye Name: 2-methyl-5-nitro-N-[(4-nitrophenyl)methyl]aniline CAS Name: 2-methyl-5-nitro-N-[(4-nitrophenyl)methyl]aniline IUPAC Name: 2-methyl-5-nitro-N-[(4-nitrophenyl)methyl]aniline Traditional Name: (2-methyl-5-nitro-phenyl)-(4-nitrobenzyl)amine Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O4/c1-10-2-5-13(17(20)21)8-14(10)15-9-11-3-6-12(7-4-11)16(18)19/h2-8,15H,9H2,1H3