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

Systemtic Name: [6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-methyl-amino]pyridin-3-yl] hydrogen carbonate Openeye Name: [6-[(2-benzyloxy-5-bromo-phenyl)methyl-methyl-amino]-3-pyridyl] hydrogen carbonate CAS Name: carbonic acid [6-[(5-bromo-2-phenylmethoxyphenyl)methyl-methylamino]-3-pyridinyl] ester IUPAC Name: [6-[(5-bromo-2-phenylmethoxyphenyl)methyl-methylamino]pyridin-3-yl] hydrogen carbonate Traditional Name: carbonic acid [6-[(2-benzoxy-5-bromo-benzyl)-methyl-amino]-3-pyridyl] ester Formula: C21H19BrN2O4 MolecularWeight: 443.29056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrN2O4/c1-24(20-10-8-18(12-23-20)28-21(25)26)13-16-11-17(22)7-9-19(16)27-14-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3,(H,25,26)