5,6,7-trimethoxyisoquinoline-3-carboxylic acid

Systemtic Name: 5,6,7-trimethoxyisoquinoline-3-carboxylic acid Openeye Name: 5,6,7-trimethoxyisoquinoline-3-carboxylic acid CAS Name: 5,6,7-trimethoxy-3-isoquinolinecarboxylic acid IUPAC Name: 5,6,7-trimethoxyisoquinoline-3-carboxylic acid Traditional Name: 5,6,7-trimethoxyisoquinoline-3-carboxylic acid Formula: C13H13NO5 MolecularWeight: 263.24602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C=C(N=CC2=C1)C(=O)O)OC)OC

Isomeric SMILES

COC1=C(C(=C2C=C(N=CC2=C1)C(=O)O)OC)OC

InChI

InChI=1S/C13H13NO5/c1-17-10-4-7-6-14-9(13(15)16)5-8(7)11(18-2)12(10)19-3/h4-6H,1-3H3,(H,15,16)