(E)-3-(4-butoxy-3-ethoxy-phenyl)-1-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-1-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-1-(4-morpholinosulfonylphenyl)prop-2-en-1-one CAS Name: (E)-3-(4-butoxy-3-ethoxyphenyl)-1-[4-(4-morpholinylsulfonyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(4-butoxy-3-ethoxyphenyl)-1-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-1-(4-morpholinosulfonylphenyl)prop-2-en-1-one Formula: C25H31NO6S MolecularWeight: 473.58174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)OCC

InChI

InChI=1S/C25H31NO6S/c1-3-5-16-32-24-13-7-20(19-25(24)31-4-2)6-12-23(27)21-8-10-22(11-9-21)33(28,29)26-14-17-30-18-15-26/h6-13,19H,3-5,14-18H2,1-2H3/b12-6+