4-[(4-methylphenyl)sulfonyl-pyrazol-1-yl-methyl]phenol

Systemtic Name: 4-[(4-methylphenyl)sulfonyl-pyrazol-1-yl-methyl]phenol Openeye Name: 4-[p-tolylsulfonyl(pyrazol-1-yl)methyl]phenol CAS Name: 4-[(4-methylphenyl)sulfonyl-(1-pyrazolyl)methyl]phenol IUPAC Name: 4-[(4-methylphenyl)sulfonyl-pyrazol-1-ylmethyl]phenol Traditional Name: 4-[pyrazol-1-yl(tosyl)methyl]phenol Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C2=CC=C(C=C2)O)N3C=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C2=CC=C(C=C2)O)N3C=CC=N3

InChI

InChI=1S/C17H16N2O3S/c1-13-3-9-16(10-4-13)23(21,22)17(19-12-2-11-18-19)14-5-7-15(20)8-6-14/h2-12,17,20H,1H3