3-(5-bromanyl-2-methoxy-phenyl)-1-(4-oxidanyl-4-phenyl-piperidin-1-yl)prop-2-en-1-one

Systemtic Name: 3-(5-bromanyl-2-methoxy-phenyl)-1-(4-oxidanyl-4-phenyl-piperidin-1-yl)prop-2-en-1-one Openeye Name: 3-(5-bromo-2-methoxy-phenyl)-1-(4-hydroxy-4-phenyl-1-piperidyl)prop-2-en-1-one CAS Name: 3-(5-bromo-2-methoxyphenyl)-1-(4-hydroxy-4-phenyl-1-piperidinyl)-2-propen-1-one IUPAC Name: 3-(5-bromo-2-methoxyphenyl)-1-(4-hydroxy-4-phenylpiperidin-1-yl)prop-2-en-1-one Traditional Name: 3-(5-bromo-2-methoxy-phenyl)-1-(4-hydroxy-4-phenyl-piperidino)prop-2-en-1-one Formula: C21H22BrNO3 MolecularWeight: 416.30828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22BrNO3/c1-26-19-9-8-18(22)15-16(19)7-10-20(24)23-13-11-21(25,12-14-23)17-5-3-2-4-6-17/h2-10,15,25H,11-14H2,1H3