5-azanyl-1-ethoxy-isoquinoline-4-carboxylic acid

Systemtic Name: 5-azanyl-1-ethoxy-isoquinoline-4-carboxylic acid Openeye Name: 5-amino-1-ethoxy-isoquinoline-4-carboxylic acid CAS Name: 5-amino-1-ethoxy-4-isoquinolinecarboxylic acid IUPAC Name: 5-amino-1-ethoxyisoquinoline-4-carboxylic acid Traditional Name: 5-amino-1-ethoxy-isoquinoline-4-carboxylic acid Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=C(C2=C1C=CC=C2N)C(=O)O

Isomeric SMILES

CCOC1=NC=C(C2=C1C=CC=C2N)C(=O)O

InChI

InChI=1S/C12H12N2O3/c1-2-17-11-7-4-3-5-9(13)10(7)8(6-14-11)12(15)16/h3-6H,2,13H2,1H3,(H,15,16)