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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)-6-methyl-chromen-4-ylidene]-4-methyl-piperazin-1-ium perchlorate Openeye Name: 1-[2-(3,4-dimethoxyphenyl)-6-methyl-chromen-4-ylidene]-4-methyl-piperazin-1-ium perchlorate CAS Name: 1-[2-(3,4-dimethoxyphenyl)-6-methyl-1-benzopyran-4-ylidene]-4-methylpiperazin-1-ium perchlorate IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)-6-methylchromen-4-ylidene]-4-methylpiperazin-1-ium perchlorate Traditional Name: 1-[2-(3,4-dimethoxyphenyl)-6-methyl-chromen-4-ylidene]-4-methyl-piperazin-1-ium perchlorate Formula: C23H27ClN2O7 MolecularWeight: 478.92268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=CC2=[N+]3CCN(CC3)C)C4=CC(=C(C=C4)OC)OC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=CC2=[N+]3CCN(CC3)C)C4=CC(=C(C=C4)OC)OC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C23H27N2O3.ClHO4/c1-16-5-7-20-18(13-16)19(25-11-9-24(2)10-12-25)15-22(28-20)17-6-8-21(26-3)23(14-17)27-4;2-1(3,4)5/h5-8,13-15H,9-12H2,1-4H3;(H,2,3,4,5)/q+1;/p-1