2-(2,3-dihydro-1H-inden-5-yl)-1-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-yl)-1-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-2-indan-5-yl-ethanone CAS Name: 2-(2,3-dihydro-1H-inden-5-yl)-1-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(2,3-dihydro-1H-inden-5-yl)-1-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 2-indan-5-yl-1-(4-veratrylpiperazin-4-ium-1-yl)ethanone Formula: C24H31N2O3+ MolecularWeight: 395.51454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CCN(CC2)C(=O)CC3=CC4=C(CCC4)C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CCN(CC2)C(=O)CC3=CC4=C(CCC4)C=C3)OC

InChI

InChI=1S/C24H30N2O3/c1-28-22-9-7-19(15-23(22)29-2)17-25-10-12-26(13-11-25)24(27)16-18-6-8-20-4-3-5-21(20)14-18/h6-9,14-15H,3-5,10-13,16-17H2,1-2H3/p+1