tert-butyl 6-(5-bromanylpyrazin-2-yl)oxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: tert-butyl 6-(5-bromanylpyrazin-2-yl)oxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: tert-butyl 6-(5-bromopyrazin-2-yl)oxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 6-[(5-bromo-2-pyrazinyl)oxy]-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-(5-bromopyrazin-2-yl)oxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 6-(5-bromopyrazin-2-yl)oxy-4-(methoxymethyl)-9H-$b-carboline-3-carboxylic acid tert-butyl ester Formula: C22H21BrN4O4 MolecularWeight: 485.33054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC(=C3)OC4=CN=C(C=N4)Br

Isomeric SMILES

CC(C)(C)OC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC(=C3)OC4=CN=C(C=N4)Br

InChI

InChI=1S/C22H21BrN4O4/c1-22(2,3)31-21(28)20-14(11-29-4)19-13-7-12(30-18-10-24-17(23)9-25-18)5-6-15(13)27-16(19)8-26-20/h5-10,27H,11H2,1-4H3