2-azanyl-3-[4-azanyl-3,5-bis(bromanyl)phenyl]-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]propan-1-one

Systemtic Name: 2-azanyl-3-[4-azanyl-3,5-bis(bromanyl)phenyl]-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]propan-1-one Openeye Name: 2-amino-3-(4-amino-3,5-dibromo-phenyl)-1-[4-(1-methyl-4-piperidyl)-1-piperidyl]propan-1-one CAS Name: 2-amino-3-(4-amino-3,5-dibromophenyl)-1-[4-(1-methyl-4-piperidinyl)-1-piperidinyl]-1-propanone IUPAC Name: 2-amino-3-(4-amino-3,5-dibromophenyl)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]propan-1-one Traditional Name: 2-amino-3-(4-amino-3,5-dibromo-phenyl)-1-[4-(1-methyl-4-piperidyl)piperidino]propan-1-one Formula: C20H30Br2N4O MolecularWeight: 502.2864

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2CCN(CC2)C(=O)C(CC3=CC(=C(C(=C3)Br)N)Br)N

Isomeric SMILES

CN1CCC(CC1)C2CCN(CC2)C(=O)C(CC3=CC(=C(C(=C3)Br)N)Br)N

InChI

InChI=1S/C20H30Br2N4O/c1-25-6-2-14(3-7-25)15-4-8-26(9-5-15)20(27)18(23)12-13-10-16(21)19(24)17(22)11-13/h10-11,14-15,18H,2-9,12,23-24H2,1H3