[6-[[5-bromanyl-2-[(4-bromophenyl)methoxy]phenyl]methyl-ethyl-amino]pyridin-3-yl] hydrogen carbonate

Systemtic Name: [6-[[5-bromanyl-2-[(4-bromophenyl)methoxy]phenyl]methyl-ethyl-amino]pyridin-3-yl] hydrogen carbonate Openeye Name: [6-[[5-bromo-2-[(4-bromophenyl)methoxy]phenyl]methyl-ethyl-amino]-3-pyridyl] hydrogen carbonate CAS Name: carbonic acid [6-[[5-bromo-2-[(4-bromophenyl)methoxy]phenyl]methyl-ethylamino]-3-pyridinyl] ester IUPAC Name: [6-[[5-bromo-2-[(4-bromophenyl)methoxy]phenyl]methyl-ethylamino]pyridin-3-yl] hydrogen carbonate Traditional Name: carbonic acid [6-[[5-bromo-2-(4-bromobenzyl)oxy-benzyl]-ethyl-amino]-3-pyridyl] ester Formula: C22H20Br2N2O4 MolecularWeight: 536.2132

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)Br)C3=NC=C(C=C3)OC(=O)O

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)Br)C3=NC=C(C=C3)OC(=O)O

InChI

InChI=1S/C22H20Br2N2O4/c1-2-26(21-10-8-19(12-25-21)30-22(27)28)13-16-11-18(24)7-9-20(16)29-14-15-3-5-17(23)6-4-15/h3-12H,2,13-14H2,1H3,(H,27,28)