5-[(3,4-dimethylphenyl)amino]-2,4-dinitro-phenol

Systemtic Name: 5-[(3,4-dimethylphenyl)amino]-2,4-dinitro-phenol Openeye Name: 5-(3,4-dimethylanilino)-2,4-dinitro-phenol CAS Name: 5-(3,4-dimethylanilino)-2,4-dinitrophenol IUPAC Name: 5-(3,4-dimethylanilino)-2,4-dinitrophenol Traditional Name: 5-(3,4-dimethylanilino)-2,4-dinitro-phenol Formula: C14H13N3O5 MolecularWeight: 303.27012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])O)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])O)C

InChI

InChI=1S/C14H13N3O5/c1-8-3-4-10(5-9(8)2)15-11-6-14(18)13(17(21)22)7-12(11)16(19)20/h3-7,15,18H,1-2H3