(E)-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)-1-[4-(phenylsulfonyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)-1-[4-(phenylsulfonyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(3-chloro-5-methoxy-4-propoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-[4-(benzenesulfonyl)-1-piperazinyl]-3-(3-chloro-5-methoxy-4-propoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(3-chloro-5-methoxy-4-propoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-besylpiperazino)-3-(3-chloro-5-methoxy-4-propoxy-phenyl)prop-2-en-1-one Formula: C23H27ClN2O5S MolecularWeight: 478.98888

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)/C=C/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C23H27ClN2O5S/c1-3-15-31-23-20(24)16-18(17-21(23)30-2)9-10-22(27)25-11-13-26(14-12-25)32(28,29)19-7-5-4-6-8-19/h4-10,16-17H,3,11-15H2,1-2H3/b10-9+