(E)-3-(4-tert-butylphenyl)-1-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-tert-butylphenyl)-1-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-tert-butylphenyl)-1-(4-morpholinosulfonylphenyl)prop-2-en-1-one CAS Name: (E)-3-(4-tert-butylphenyl)-1-[4-(4-morpholinylsulfonyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(4-tert-butylphenyl)-1-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-tert-butylphenyl)-1-(4-morpholinosulfonylphenyl)prop-2-en-1-one Formula: C23H27NO4S MolecularWeight: 413.52978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO4S/c1-23(2,3)20-9-4-18(5-10-20)6-13-22(25)19-7-11-21(12-8-19)29(26,27)24-14-16-28-17-15-24/h4-13H,14-17H2,1-3H3/b13-6+