13-(cyclopropylmethyl)-2,3,9,10-tetramethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium

Systemtic Name: 13-(cyclopropylmethyl)-2,3,9,10-tetramethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium Openeye Name: 13-(cyclopropylmethyl)-2,3,9,10-tetramethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium CAS Name: 13-(cyclopropylmethyl)-2,3,9,10-tetramethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium IUPAC Name: 13-(cyclopropylmethyl)-2,3,9,10-tetramethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium Traditional Name: 13-(cyclopropylmethyl)-2,3,9,10-tetramethoxy-5,6-dihydroisoquinolin[2,1-b]isoquinolin-7-ium Formula: C25H28NO4+ MolecularWeight: 406.49412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C[N+]3=C(C4=CC(=C(C=C4CC3)OC)OC)C(=C2C=C1)CC5CC5)OC

Isomeric SMILES

COC1=C(C2=C[N+]3=C(C4=CC(=C(C=C4CC3)OC)OC)C(=C2C=C1)CC5CC5)OC

InChI

InChI=1S/C25H28NO4/c1-27-21-8-7-17-19(11-15-5-6-15)24-18-13-23(29-3)22(28-2)12-16(18)9-10-26(24)14-20(17)25(21)30-4/h7-8,12-15H,5-6,9-11H2,1-4H3/q+1