bromanylbenzene; 6,7-dimethoxy-2-[(4-oxidanylpiperidin-1-yl)methyl]-3,4-dihydro-2H-naphthalen-1-one

Systemtic Name: bromanylbenzene; 6,7-dimethoxy-2-[(4-oxidanylpiperidin-1-yl)methyl]-3,4-dihydro-2H-naphthalen-1-one Openeye Name: bromobenzene; 2-[(4-hydroxy-1-piperidyl)methyl]-6,7-dimethoxy-tetralin-1-one CAS Name: bromobenzene; 2-[(4-hydroxy-1-piperidinyl)methyl]-6,7-dimethoxy-3,4-dihydro-2H-naphthalen-1-one IUPAC Name: bromobenzene; 2-[(4-hydroxypiperidin-1-yl)methyl]-6,7-dimethoxy-3,4-dihydro-2H-naphthalen-1-one Traditional Name: bromobenzene; 2-[(4-hydroxypiperidino)methyl]-6,7-dimethoxy-tetralin-1-one Formula: C24H30BrNO4 MolecularWeight: 476.4033

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCC(C2=O)CN3CCC(CC3)O)OC.C1=CC=C(C=C1)Br

Isomeric SMILES

COC1=C(C=C2C(=C1)CCC(C2=O)CN3CCC(CC3)O)OC.C1=CC=C(C=C1)Br

InChI

InChI=1S/C18H25NO4.C6H5Br/c1-22-16-9-12-3-4-13(11-19-7-5-14(20)6-8-19)18(21)15(12)10-17(16)23-2;7-6-4-2-1-3-5-6/h9-10,13-14,20H,3-8,11H2,1-2H3;1-5H