2-methoxy-6-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-4-prop-2-enyl-phenol

Systemtic Name: 2-methoxy-6-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-4-prop-2-enyl-phenol Openeye Name: 4-allyl-2-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-6-methoxy-phenol CAS Name: 2-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-6-methoxy-4-prop-2-enylphenol IUPAC Name: 2-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-6-methoxy-4-prop-2-enylphenol Traditional Name: 4-allyl-2-[(4-besylpiperazino)methyl]-6-methoxy-phenol Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)CC=C

Isomeric SMILES

COC1=CC(=CC(=C1O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)CC=C

InChI

InChI=1S/C21H26N2O4S/c1-3-7-17-14-18(21(24)20(15-17)27-2)16-22-10-12-23(13-11-22)28(25,26)19-8-5-4-6-9-19/h3-6,8-9,14-15,24H,1,7,10-13,16H2,2H3