3-[(1S)-6,7-bis(oxidanyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]chromen-4-one

Systemtic Name: 3-[(1S)-6,7-bis(oxidanyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]chromen-4-one Openeye Name: 3-[(1S)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl]chromen-4-one CAS Name: 3-[(1S)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl]-1-benzopyran-4-one IUPAC Name: 3-[(1S)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl]chromen-4-one Traditional Name: 3-[(1S)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl]chromone Formula: C18H15NO4 MolecularWeight: 309.316

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=CC(=C(C=C21)O)O)C3=COC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN[C@@H](C2=CC(=C(C=C21)O)O)C3=COC4=CC=CC=C4C3=O

InChI

InChI=1S/C18H15NO4/c20-14-7-10-5-6-19-17(12(10)8-15(14)21)13-9-23-16-4-2-1-3-11(16)18(13)22/h1-4,7-9,17,19-21H,5-6H2/t17-/m0/s1