(2-bromophenyl)-[4,6-dimethoxy-2-oxidanyl-3-(piperidin-1-ylmethyl)phenyl]methanone

Systemtic Name: (2-bromophenyl)-[4,6-dimethoxy-2-oxidanyl-3-(piperidin-1-ylmethyl)phenyl]methanone Openeye Name: (2-bromophenyl)-[2-hydroxy-4,6-dimethoxy-3-(1-piperidylmethyl)phenyl]methanone CAS Name: (2-bromophenyl)-[2-hydroxy-4,6-dimethoxy-3-(1-piperidinylmethyl)phenyl]methanone IUPAC Name: (2-bromophenyl)-[2-hydroxy-4,6-dimethoxy-3-(piperidin-1-ylmethyl)phenyl]methanone Traditional Name: (2-bromophenyl)-[2-hydroxy-4,6-dimethoxy-3-(piperidinomethyl)phenyl]methanone Formula: C21H24BrNO4 MolecularWeight: 434.32356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1C(=O)C2=CC=CC=C2Br)O)CN3CCCCC3)OC

Isomeric SMILES

COC1=CC(=C(C(=C1C(=O)C2=CC=CC=C2Br)O)CN3CCCCC3)OC

InChI

InChI=1S/C21H24BrNO4/c1-26-17-12-18(27-2)19(20(24)14-8-4-5-9-16(14)22)21(25)15(17)13-23-10-6-3-7-11-23/h4-5,8-9,12,25H,3,6-7,10-11,13H2,1-2H3