2-methoxy-6-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-4-[(E)-prop-1-enyl]phenol

Systemtic Name: 2-methoxy-6-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-4-[(E)-prop-1-enyl]phenol Openeye Name: 2-methoxy-4-[(E)-prop-1-enyl]-6-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]phenol CAS Name: 2-methoxy-6-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-4-[(E)-prop-1-enyl]phenol IUPAC Name: 2-methoxy-6-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-4-[(E)-prop-1-enyl]phenol Traditional Name: 2-methoxy-4-[(E)-prop-1-enyl]-6-[(4-tosylpiperazino)methyl]phenol Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CC(=C(C(=C1)OC)O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

C/C=C/C1=CC(=C(C(=C1)OC)O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H28N2O4S/c1-4-5-18-14-19(22(25)21(15-18)28-3)16-23-10-12-24(13-11-23)29(26,27)20-8-6-17(2)7-9-20/h4-9,14-15,25H,10-13,16H2,1-3H3/b5-4+