(4S)-6-methoxy-4-(3-methyl-4-oxidanyl-phenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol

Systemtic Name: (4S)-6-methoxy-4-(3-methyl-4-oxidanyl-phenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol Openeye Name: (4S)-4-(4-hydroxy-3-methyl-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol CAS Name: (4S)-4-(4-hydroxy-3-methylphenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol IUPAC Name: (4S)-4-(4-hydroxy-3-methylphenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol Traditional Name: (4S)-4-(4-hydroxy-3-methyl-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol Formula: C17H20NO3+ MolecularWeight: 286.3456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2C[NH2+]CC3=CC(=C(C=C23)OC)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)[C@@H]2C[NH2+]CC3=CC(=C(C=C23)OC)O)O

InChI

InChI=1S/C17H19NO3/c1-10-5-11(3-4-15(10)19)14-9-18-8-12-6-16(20)17(21-2)7-13(12)14/h3-7,14,18-20H,8-9H2,1-2H3/p+1/t14-/m0/s1