(2-methyl-2-oxidanyl-propyl) 6-(5-bromanylpyridin-2-yl)oxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: (2-methyl-2-oxidanyl-propyl) 6-(5-bromanylpyridin-2-yl)oxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: (2-hydroxy-2-methyl-propyl) 6-[(5-bromo-2-pyridyl)oxy]-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 6-[(5-bromo-2-pyridinyl)oxy]-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid (2-hydroxy-2-methylpropyl) ester IUPAC Name: (2-hydroxy-2-methylpropyl) 6-(5-bromopyridin-2-yl)oxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 6-[(5-bromo-2-pyridyl)oxy]-4-(methoxymethyl)-9H-$b-carboline-3-carboxylic acid (2-hydroxy-2-methyl-propyl) ester Formula: C23H22BrN3O5 MolecularWeight: 500.34188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC(=C3)OC4=NC=C(C=C4)Br)O

Isomeric SMILES

CC(C)(COC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC(=C3)OC4=NC=C(C=C4)Br)O

InChI

InChI=1S/C23H22BrN3O5/c1-23(2,29)12-31-22(28)21-16(11-30-3)20-15-8-14(32-19-7-4-13(24)9-25-19)5-6-17(15)27-18(20)10-26-21/h4-10,27,29H,11-12H2,1-3H3