ethyl 1-deuterio-1-oxidanyl-isoquinoline-2-carboxylate

Systemtic Name: ethyl 1-deuterio-1-oxidanyl-isoquinoline-2-carboxylate Openeye Name: ethyl 1-deuterio-1-hydroxy-isoquinoline-2-carboxylate CAS Name: 1-deuterio-1-hydroxy-2-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-deuterio-1-hydroxyisoquinoline-2-carboxylate Traditional Name: 1-deuterio-1-hydroxy-isoquinoline-2-carboxylic acid ethyl ester Formula: C12H13NO3 MolecularWeight: 220.242682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=CC2=CC=CC=C2C1O

Isomeric SMILES

[2H]C1(C2=CC=CC=C2C=CN1C(=O)OCC)O

InChI

InChI=1S/C12H13NO3/c1-2-16-12(15)13-8-7-9-5-3-4-6-10(9)11(13)14/h3-8,11,14H,2H2,1H3/i11D