4-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-nitro-phenol

Systemtic Name: 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-nitro-phenol Openeye Name: 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-nitro-phenol CAS Name: 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-nitrophenol IUPAC Name: 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-nitrophenol Traditional Name: 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-nitro-phenol Formula: C12H14N4O3 MolecularWeight: 262.26456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CNC2=C(C=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C)CNC2=C(C=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O3/c1-7-10(8(2)15-14-7)6-13-11-4-3-9(17)5-12(11)16(18)19/h3-5,13,17H,6H2,1-2H3,(H,14,15)