(E)-3-(5-bromanyl-2-methoxy-phenyl)-1-[4-(phenylcarbonyl)piperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-1-[4-(phenylcarbonyl)piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-(4-benzoyl-1-piperidyl)-3-(5-bromo-2-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(4-benzoyl-1-piperidinyl)-3-(5-bromo-2-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-benzoylpiperidin-1-yl)-3-(5-bromo-2-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-benzoylpiperidino)-3-(5-bromo-2-methoxy-phenyl)prop-2-en-1-one Formula: C22H22BrNO3 MolecularWeight: 428.31898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)N2CCC(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)N2CCC(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H22BrNO3/c1-27-20-9-8-19(23)15-18(20)7-10-21(25)24-13-11-17(12-14-24)22(26)16-5-3-2-4-6-16/h2-10,15,17H,11-14H2,1H3/b10-7+