ethyl 6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: ethyl 6,7-bis(oxidanyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: ethyl 6,7-dihydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 6,7-dihydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6,7-dihydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 6,7-dihydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester Formula: C12H15NO4 MolecularWeight: 237.2518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=CC(=C(C=C2C1)O)O

Isomeric SMILES

CCOC(=O)N1CCC2=CC(=C(C=C2C1)O)O

InChI

InChI=1S/C12H15NO4/c1-2-17-12(16)13-4-3-8-5-10(14)11(15)6-9(8)7-13/h5-6,14-15H,2-4,7H2,1H3