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

Systemtic Name: (1R)-1-(4-propan-2-ylphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol Openeye Name: (1R)-1-(4-isopropylphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol CAS Name: (1R)-1-(4-propan-2-ylphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol IUPAC Name: (1R)-1-(4-propan-2-ylphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol Traditional Name: (1R)-1-p-cumenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol Formula: C18H22NO2+ MolecularWeight: 284.37278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO2/c1-11(2)12-3-5-13(6-4-12)18-15-10-17(21)16(20)9-14(15)7-8-19-18/h3-6,9-11,18-21H,7-8H2,1-2H3/p+1/t18-/m1/s1