1,3,3,4,4,5,8-heptadeuterio-1-methyl-2H-isoquinoline-6,7-diol

Systemtic Name: 1,3,3,4,4,5,8-heptadeuterio-1-methyl-2H-isoquinoline-6,7-diol Openeye Name: 1,3,3,4,4,5,8-heptadeuterio-1-methyl-2H-isoquinoline-6,7-diol CAS Name: 1,3,3,4,4,5,8-heptadeuterio-1-methyl-2H-isoquinoline-6,7-diol IUPAC Name: 1,3,3,4,4,5,8-heptadeuterio-1-methyl-2H-isoquinoline-6,7-diol Traditional Name: 1,3,3,4,4,5,8-heptadeuterio-1-methyl-2H-isoquinoline-6,7-diol Formula: C10H13NO2 MolecularWeight: 186.258852

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1)O)O

Isomeric SMILES

[2H]C1=C2C(=C(C(=C1O)O)[2H])C(NC(C2([2H])[2H])([2H])[2H])([2H])C

InChI

InChI=1S/C10H13NO2/c1-6-8-5-10(13)9(12)4-7(8)2-3-11-6/h4-6,11-13H,2-3H2,1H3/i2D2,3D2,4D,5D,6D