2-(3,4-dimethoxyphenyl)ethyl-[2-(4-methoxyphenyl)-6-oxidanyl-chromen-4-ylidene]azanium perchlorate

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-(4-methoxyphenyl)-6-oxidanyl-chromen-4-ylidene]azanium perchlorate Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]ammonium perchlorate CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[6-hydroxy-2-(4-methoxyphenyl)-1-benzopyran-4-ylidene]ammonium perchlorate IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]azanium perchlorate Traditional Name: homoveratryl-[6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]ammonium perchlorate Formula: C26H26ClNO9 MolecularWeight: 531.93894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=[NH+]CCC3=CC(=C(C=C3)OC)OC)C4=C(O2)C=CC(=C4)O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=[NH+]CCC3=CC(=C(C=C3)OC)OC)C4=C(O2)C=CC(=C4)O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C26H25NO5.ClHO4/c1-29-20-8-5-18(6-9-20)25-16-22(21-15-19(28)7-11-23(21)32-25)27-13-12-17-4-10-24(30-2)26(14-17)31-3;2-1(3,4)5/h4-11,14-16,28H,12-13H2,1-3H3;(H,2,3,4,5)