8-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-2-methyl-7-oxidanyl-3-phenyl-chromen-4-one

Systemtic Name: 8-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-2-methyl-7-oxidanyl-3-phenyl-chromen-4-one Openeye Name: 8-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-7-hydroxy-2-methyl-3-phenyl-chromen-4-one CAS Name: 8-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-7-hydroxy-2-methyl-3-phenyl-1-benzopyran-4-one IUPAC Name: 8-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-7-hydroxy-2-methyl-3-phenylchromen-4-one Traditional Name: 8-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-7-hydroxy-2-methyl-3-phenyl-chromone Formula: C28H28NO5+ MolecularWeight: 458.52562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)C[NH+]3CCC4=CC(=C(C=C4C3)OC)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)C[NH+]3CCC4=CC(=C(C=C4C3)OC)OC)C5=CC=CC=C5

InChI

InChI=1S/C28H27NO5/c1-17-26(18-7-5-4-6-8-18)27(31)21-9-10-23(30)22(28(21)34-17)16-29-12-11-19-13-24(32-2)25(33-3)14-20(19)15-29/h4-10,13-14,30H,11-12,15-16H2,1-3H3/p+1