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

Systemtic Name: 8-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-6-ethyl-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: 8-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-6-ethyl-7-hydroxy-4-methyl-chromen-2-one CAS Name: 8-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-6-ethyl-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 8-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-6-ethyl-7-hydroxy-4-methylchromen-2-one Traditional Name: 8-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-6-ethyl-7-hydroxy-4-methyl-coumarin Formula: C24H28NO5+ MolecularWeight: 410.48282

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)C[NH+]3CCC4=CC(=C(C=C4C3)OC)OC)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)C[NH+]3CCC4=CC(=C(C=C4C3)OC)OC)O

InChI

InChI=1S/C24H27NO5/c1-5-15-9-18-14(2)8-22(26)30-24(18)19(23(15)27)13-25-7-6-16-10-20(28-3)21(29-4)11-17(16)12-25/h8-11,27H,5-7,12-13H2,1-4H3/p+1