8-cyclopropyl-2,3,10,11,12-pentamethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium

Systemtic Name: 8-cyclopropyl-2,3,10,11,12-pentamethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium Openeye Name: 8-cyclopropyl-2,3,10,11,12-pentamethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium CAS Name: 8-cyclopropyl-2,3,10,11,12-pentamethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium IUPAC Name: 8-cyclopropyl-2,3,10,11,12-pentamethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium Traditional Name: 8-cyclopropyl-2,3,10,11,12-pentamethoxy-5,6-dihydroisoquinolin[2,1-b]isoquinolin-7-ium Formula: C25H28NO5+ MolecularWeight: 422.49352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC[N+]3=C(C4=CC(=C(C(=C4C=C23)OC)OC)OC)C5CC5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC[N+]3=C(C4=CC(=C(C(=C4C=C23)OC)OC)OC)C5CC5)OC

InChI

InChI=1S/C25H28NO5/c1-27-20-10-15-8-9-26-19(16(15)12-21(20)28-2)11-18-17(23(26)14-6-7-14)13-22(29-3)25(31-5)24(18)30-4/h10-14H,6-9H2,1-5H3/q+1