2-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)amino]-1-phenyl-ethanol

Systemtic Name: 2-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)amino]-1-phenyl-ethanol Openeye Name: 2-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)amino]-1-phenyl-ethanol CAS Name: 2-[(2,5-dimethyl-4-nitro-3-pyrazolyl)amino]-1-phenylethanol IUPAC Name: 2-[(2,5-dimethyl-4-nitropyrazol-3-yl)amino]-1-phenylethanol Traditional Name: 2-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)amino]-1-phenyl-ethanol Formula: C13H16N4O3 MolecularWeight: 276.29114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N4O3/c1-9-12(17(19)20)13(16(2)15-9)14-8-11(18)10-6-4-3-5-7-10/h3-7,11,14,18H,8H2,1-2H3