(E)-3-(3-methoxy-4-prop-2-enoxy-phenyl)-1-[4-(phenylsulfonyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3-methoxy-4-prop-2-enoxy-phenyl)-1-[4-(phenylsulfonyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-allyloxy-3-methoxy-phenyl)-1-[4-(benzenesulfonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-1-[4-(benzenesulfonyl)-1-piperazinyl]-3-(3-methoxy-4-prop-2-enoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-allyloxy-3-methoxy-phenyl)-1-(4-besylpiperazino)prop-2-en-1-one Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)OCC=C

InChI

InChI=1S/C23H26N2O5S/c1-3-17-30-21-11-9-19(18-22(21)29-2)10-12-23(26)24-13-15-25(16-14-24)31(27,28)20-7-5-4-6-8-20/h3-12,18H,1,13-17H2,2H3/b12-10+