13-ethyl-9,10-dimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2,3-diol

Systemtic Name: 13-ethyl-9,10-dimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2,3-diol Openeye Name: 13-ethyl-9,10-dimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2,3-diol CAS Name: 13-ethyl-9,10-dimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2,3-diol IUPAC Name: 13-ethyl-9,10-dimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2,3-diol Traditional Name: 13-ethyl-9,10-dimethoxy-5,6-dihydroisoquinolin[2,1-b]isoquinolin-7-ium-2,3-diol Formula: C21H22NO4+ MolecularWeight: 352.40368

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=CC(=C(C2=C[N+]3=C1C4=CC(=C(C=C4CC3)O)O)OC)OC

Isomeric SMILES

CCC1=C2C=CC(=C(C2=C[N+]3=C1C4=CC(=C(C=C4CC3)O)O)OC)OC

InChI

InChI=1S/C21H21NO4/c1-4-13-14-5-6-19(25-2)21(26-3)16(14)11-22-8-7-12-9-17(23)18(24)10-15(12)20(13)22/h5-6,9-11,24H,4,7-8H2,1-3H3/p+1