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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)-6-methyl-chromen-4-ylidene]-4-methyl-piperidin-1-ium perchlorate Openeye Name: 1-[2-(3,4-dimethoxyphenyl)-6-methyl-chromen-4-ylidene]-4-methyl-piperidin-1-ium perchlorate CAS Name: 1-[2-(3,4-dimethoxyphenyl)-6-methyl-1-benzopyran-4-ylidene]-4-methylpiperidin-1-ium perchlorate IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)-6-methylchromen-4-ylidene]-4-methylpiperidin-1-ium perchlorate Traditional Name: 1-[2-(3,4-dimethoxyphenyl)-6-methyl-chromen-4-ylidene]-4-methyl-piperidin-1-ium perchlorate Formula: C24H28ClNO7 MolecularWeight: 477.93462

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[N+](=C2C=C(OC3=C2C=C(C=C3)C)C4=CC(=C(C=C4)OC)OC)CC1.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1CC[N+](=C2C=C(OC3=C2C=C(C=C3)C)C4=CC(=C(C=C4)OC)OC)CC1.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C24H28NO3.ClHO4/c1-16-9-11-25(12-10-16)20-15-23(28-21-7-5-17(2)13-19(20)21)18-6-8-22(26-3)24(14-18)27-4;2-1(3,4)5/h5-8,13-16H,9-12H2,1-4H3;(H,2,3,4,5)/q+1;/p-1