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6,7-bis(oxidanyl)-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

6,7-bis(oxidanyl)-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name:6,7-bis(oxidanyl)-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Openeye Name:2-benzoyl-6,7-dihydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
CAS Name:2-benzoyl-6,7-dihydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
IUPAC Name:2-benzoyl-6,7-dihydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Traditional Name:2-benzoyl-6,7-dihydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Formula: C17H15NO5
MolecularWeight: 313.3047
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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC(=C(C=C21)O)O)C(=O)C3=CC=CC=C3)C(=O)O


Isomeric SMILES

C1C(N(CC2=CC(=C(C=C21)O)O)C(=O)C3=CC=CC=C3)C(=O)O


InChI

InChI=1S/C17H15NO5/c19-14-7-11-6-13(17(22)23)18(9-12(11)8-15(14)20)16(21)10-4-2-1-3-5-10/h1-5,7-8,13,19-20H,6,9H2,(H,22,23)


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