(1R)-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol

Systemtic Name: (1R)-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol Openeye Name: (1R)-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol CAS Name: (1R)-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol IUPAC Name: (1R)-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol Traditional Name: (1R)-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol Formula: C16H18NO3+ MolecularWeight: 272.31902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C3=CC(=C(C=C3CC[NH2+]2)O)O

Isomeric SMILES

COC1=CC=CC(=C1)[C@@H]2C3=CC(=C(C=C3CC[NH2+]2)O)O

InChI

InChI=1S/C16H17NO3/c1-20-12-4-2-3-11(7-12)16-13-9-15(19)14(18)8-10(13)5-6-17-16/h2-4,7-9,16-19H,5-6H2,1H3/p+1/t16-/m1/s1