5-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 5-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Openeye Name: 5-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid CAS Name: 5-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid IUPAC Name: 5-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Traditional Name: 5-methylol-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Formula: C11H13NO3 MolecularWeight: 207.22582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=CC=C2)CO)C(=O)O

Isomeric SMILES

C1CN(CC2=C1C(=CC=C2)CO)C(=O)O

InChI

InChI=1S/C11H13NO3/c13-7-9-3-1-2-8-6-12(11(14)15)5-4-10(8)9/h1-3,13H,4-7H2,(H,14,15)