4-[[(4-methyl-3-nitro-phenyl)amino]methyl]benzene-1,2-diol

Systemtic Name: 4-[[(4-methyl-3-nitro-phenyl)amino]methyl]benzene-1,2-diol Openeye Name: 4-[(4-methyl-3-nitro-anilino)methyl]benzene-1,2-diol CAS Name: 4-[(4-methyl-3-nitroanilino)methyl]benzene-1,2-diol IUPAC Name: 4-[(4-methyl-3-nitroanilino)methyl]benzene-1,2-diol Traditional Name: 4-[(4-methyl-3-nitro-anilino)methyl]pyrocatechol Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O4/c1-9-2-4-11(7-12(9)16(19)20)15-8-10-3-5-13(17)14(18)6-10/h2-7,15,17-18H,8H2,1H3