1-[2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-ylidene]-4-methyl-piperazin-1-ium perchlorate

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-ylidene]-4-methyl-piperazin-1-ium perchlorate Openeye Name: 1-[2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-ylidene]-4-methyl-piperazin-1-ium perchlorate CAS Name: 1-[2-(3,4-dimethoxyphenyl)-6-methoxy-1-benzopyran-4-ylidene]-4-methylpiperazin-1-ium perchlorate IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)-6-methoxychromen-4-ylidene]-4-methylpiperazin-1-ium perchlorate Traditional Name: 1-[2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-ylidene]-4-methyl-piperazin-1-ium perchlorate Formula: C23H27ClN2O8 MolecularWeight: 494.92208

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](=C2C=C(OC3=C2C=C(C=C3)OC)C4=CC(=C(C=C4)OC)OC)CC1.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CN1CC[N+](=C2C=C(OC3=C2C=C(C=C3)OC)C4=CC(=C(C=C4)OC)OC)CC1.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C23H27N2O4.ClHO4/c1-24-9-11-25(12-10-24)19-15-22(16-5-7-21(27-3)23(13-16)28-4)29-20-8-6-17(26-2)14-18(19)20;2-1(3,4)5/h5-8,13-15H,9-12H2,1-4H3;(H,2,3,4,5)/q+1;/p-1