N-[(4-methylphenyl)methyl]-2,4-dinitro-aniline

Systemtic Name: N-[(4-methylphenyl)methyl]-2,4-dinitro-aniline Openeye Name: 2,4-dinitro-N-(p-tolylmethyl)aniline CAS Name: N-[(4-methylphenyl)methyl]-2,4-dinitroaniline IUPAC Name: N-[(4-methylphenyl)methyl]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-(4-methylbenzyl)amine Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

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