2-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-4,5-dimethyl-phenol

Systemtic Name: 2-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-4,5-dimethyl-phenol Openeye Name: 2-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-4,5-dimethyl-phenol CAS Name: 2-[[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]methyl]-4,5-dimethylphenol IUPAC Name: 2-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-4,5-dimethylphenol Traditional Name: 4,5-dimethyl-2-[(4-p-phenetylsulfonylpiperazino)methyl]phenol Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=C(C(=C3)C)C)O

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=C(C(=C3)C)C)O

InChI

InChI=1S/C21H28N2O4S/c1-4-27-19-5-7-20(8-6-19)28(25,26)23-11-9-22(10-12-23)15-18-13-16(2)17(3)14-21(18)24/h5-8,13-14,24H,4,9-12,15H2,1-3H3