(E)-3-(4-chlorophenyl)-1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-chlorophenyl)-1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]prop-2-en-1-one Openeye Name: (E)-3-(4-chlorophenyl)-1-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]prop-2-en-1-one CAS Name: (E)-3-(4-chlorophenyl)-1-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-2-propen-1-one IUPAC Name: (E)-3-(4-chlorophenyl)-1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]prop-2-en-1-one Traditional Name: (E)-3-(4-chlorophenyl)-1-[4-(4-methylpiperidino)sulfonylphenyl]prop-2-en-1-one Formula: C21H22ClNO3S MolecularWeight: 403.92228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClNO3S/c1-16-12-14-23(15-13-16)27(25,26)20-9-5-18(6-10-20)21(24)11-4-17-2-7-19(22)8-3-17/h2-11,16H,12-15H2,1H3/b11-4+