2-[[2,3-bis(oxidanyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-6,7-diol

Systemtic Name: 2-[[2,3-bis(oxidanyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-6,7-diol Openeye Name: 2-[(2,3-dihydroxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-6,7-diol CAS Name: 2-[(2,3-dihydroxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-6,7-diol IUPAC Name: 2-[(2,3-dihydroxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-6,7-diol Traditional Name: 2-(2,3-dihydroxybenzyl)-3,4-dihydro-1H-isoquinoline-6,7-diol Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC(=C(C=C21)O)O)CC3=C(C(=CC=C3)O)O

Isomeric SMILES

C1CN(CC2=CC(=C(C=C21)O)O)CC3=C(C(=CC=C3)O)O

InChI

InChI=1S/C16H17NO4/c18-13-3-1-2-11(16(13)21)8-17-5-4-10-6-14(19)15(20)7-12(10)9-17/h1-3,6-7,18-21H,4-5,8-9H2