7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-3,9,10-triol

Systemtic Name: 7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-3,9,10-triol Openeye Name: 7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-3,9,10-triol CAS Name: 7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-3,9,10-triol IUPAC Name: 7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-3,9,10-triol Traditional Name: 7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolin[2,1-b]isoquinolin-7-ium-3,9,10-triol Formula: C18H20NO3+ MolecularWeight: 298.3563

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]12CCC3=C(C1CC4=C(C2)C(=C(C=C4)O)O)C=CC(=C3)O

Isomeric SMILES

C[N+]12CCC3=C(C1CC4=C(C2)C(=C(C=C4)O)O)C=CC(=C3)O

InChI

InChI=1S/C18H19NO3/c1-19-7-6-12-8-13(20)3-4-14(12)16(19)9-11-2-5-17(21)18(22)15(11)10-19/h2-5,8,16H,6-7,9-10H2,1H3,(H2-,20,21,22)/p+1