(1S)-1-(2-chloranylquinolin-3-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol

Systemtic Name: (1S)-1-(2-chloranylquinolin-3-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol Openeye Name: (1S)-1-(2-chloro-3-quinolyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol CAS Name: (1S)-1-(2-chloro-3-quinolinyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol IUPAC Name: (1S)-1-(2-chloroquinolin-3-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol Traditional Name: (1S)-1-(2-chloro-3-quinolyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol Formula: C18H16ClN2O2+ MolecularWeight: 327.78484

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]C(C2=CC(=C(C=C21)O)O)C3=CC4=CC=CC=C4N=C3Cl

Isomeric SMILES

C1C[NH2+][C@@H](C2=CC(=C(C=C21)O)O)C3=CC4=CC=CC=C4N=C3Cl

InChI

InChI=1S/C18H15ClN2O2/c19-18-13(7-11-3-1-2-4-14(11)21-18)17-12-9-16(23)15(22)8-10(12)5-6-20-17/h1-4,7-9,17,20,22-23H,5-6H2/p+1/t17-/m0/s1