[2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-ylidene]-(3-oxidanylpropyl)azanium perchlorate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-ylidene]-(3-oxidanylpropyl)azanium perchlorate Openeye Name: [2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-ylidene]-(3-hydroxypropyl)ammonium perchlorate CAS Name: [2-(3,4-dimethoxyphenyl)-6-methoxy-1-benzopyran-4-ylidene]-(3-hydroxypropyl)ammonium perchlorate IUPAC Name: [2-(3,4-dimethoxyphenyl)-6-methoxychromen-4-ylidene]-(3-hydroxypropyl)azanium perchlorate Traditional Name: [2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-ylidene]-(3-hydroxypropyl)ammonium perchlorate Formula: C21H24ClNO9 MolecularWeight: 469.86956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=CC2=[NH+]CCCO)C3=CC(=C(C=C3)OC)OC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=CC2=[NH+]CCCO)C3=CC(=C(C=C3)OC)OC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H23NO5.ClHO4/c1-24-15-6-8-18-16(12-15)17(22-9-4-10-23)13-20(27-18)14-5-7-19(25-2)21(11-14)26-3;2-1(3,4)5/h5-8,11-13,23H,4,9-10H2,1-3H3;(H,2,3,4,5)