4-(4-ethanoyl-2-methoxy-phenoxy)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: 4-(4-ethanoyl-2-methoxy-phenoxy)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butan-1-one Openeye Name: 4-(4-acetyl-2-methoxy-phenoxy)-1-[4-[(E)-styryl]sulfonylpiperazin-1-yl]butan-1-one CAS Name: 4-(4-acetyl-2-methoxyphenoxy)-1-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]-1-butanone IUPAC Name: 4-(4-acetyl-2-methoxyphenoxy)-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butan-1-one Traditional Name: 4-(4-acetyl-2-methoxy-phenoxy)-1-[4-[(E)-styryl]sulfonylpiperazino]butan-1-one Formula: C25H30N2O6S MolecularWeight: 486.5805

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCCCC(=O)N2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3)OC

InChI

InChI=1S/C25H30N2O6S/c1-20(28)22-10-11-23(24(19-22)32-2)33-17-6-9-25(29)26-13-15-27(16-14-26)34(30,31)18-12-21-7-4-3-5-8-21/h3-5,7-8,10-12,18-19H,6,9,13-17H2,1-2H3/b18-12+