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

Systemtic Name: 6-(5-bromanylpyrazin-2-yl)oxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 6-(5-bromopyrazin-2-yl)oxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 6-[(5-bromo-2-pyrazinyl)oxy]-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 6-(5-bromopyrazin-2-yl)oxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 6-(5-bromopyrazin-2-yl)oxy-4-(methoxymethyl)-9H-$b-carboline-3-carboxylic acid Formula: C18H13BrN4O4 MolecularWeight: 429.22422

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C2C3=C(C=CC(=C3)OC4=CN=C(C=N4)Br)NC2=CN=C1C(=O)O

Isomeric SMILES

COCC1=C2C3=C(C=CC(=C3)OC4=CN=C(C=N4)Br)NC2=CN=C1C(=O)O

InChI

InChI=1S/C18H13BrN4O4/c1-26-8-11-16-10-4-9(27-15-7-20-14(19)6-21-15)2-3-12(10)23-13(16)5-22-17(11)18(24)25/h2-7,23H,8H2,1H3,(H,24,25)