[5-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-6-ethoxy-pyridin-3-yl] hydrogen carbonate

Systemtic Name: [5-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-6-ethoxy-pyridin-3-yl] hydrogen carbonate Openeye Name: [5-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]-6-ethoxy-3-pyridyl] hydrogen carbonate CAS Name: carbonic acid [5-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-6-ethoxy-3-pyridinyl] ester IUPAC Name: [5-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-6-ethoxypyridin-3-yl] hydrogen carbonate Traditional Name: carbonic acid [5-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]-6-ethoxy-3-pyridyl] ester Formula: C24H25BrN2O5 MolecularWeight: 501.3697

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=CC(=CN=C3OCC)OC(=O)O

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=CC(=CN=C3OCC)OC(=O)O

InChI

InChI=1S/C24H25BrN2O5/c1-3-27(21-13-20(32-24(28)29)14-26-23(21)30-4-2)15-18-12-19(25)10-11-22(18)31-16-17-8-6-5-7-9-17/h5-14H,3-4,15-16H2,1-2H3,(H,28,29)