3-[(4-methyl-2,6-dinitro-phenyl)amino]phenol

Systemtic Name: 3-[(4-methyl-2,6-dinitro-phenyl)amino]phenol Openeye Name: 3-(4-methyl-2,6-dinitro-anilino)phenol CAS Name: 3-(4-methyl-2,6-dinitroanilino)phenol IUPAC Name: 3-(4-methyl-2,6-dinitroanilino)phenol Traditional Name: 3-(4-methyl-2,6-dinitro-anilino)phenol Formula: C13H11N3O5 MolecularWeight: 289.24354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O5/c1-8-5-11(15(18)19)13(12(6-8)16(20)21)14-9-3-2-4-10(17)7-9/h2-7,14,17H,1H3