2-[3-(2-hydroxyethylamino)-2-oxidanyl-propyl]-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol

Systemtic Name: 2-[3-(2-hydroxyethylamino)-2-oxidanyl-propyl]-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol Openeye Name: 2-[2-hydroxy-3-(2-hydroxyethylamino)propyl]-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol CAS Name: 2-[2-hydroxy-3-(2-hydroxyethylamino)propyl]-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol IUPAC Name: 2-[2-hydroxy-3-(2-hydroxyethylamino)propyl]-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol Traditional Name: 2-[2-hydroxy-3-(2-hydroxyethylamino)propyl]-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-6-ol Formula: C16H27N2O4+ MolecularWeight: 311.39658

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CC[NH+]1CC(CNCCO)O)O)OC

Isomeric SMILES

CC1C2=CC(=C(C=C2CC[NH+]1CC(CNCCO)O)O)OC

InChI

InChI=1S/C16H26N2O4/c1-11-14-8-16(22-2)15(21)7-12(14)3-5-18(11)10-13(20)9-17-4-6-19/h7-8,11,13,17,19-21H,3-6,9-10H2,1-2H3/p+1