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

Systemtic Name: 2,3-dihydro-1H-inden-5-yl-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: indan-5-yl-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: 2,3-dihydro-1H-inden-5-yl-[4-[(4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: 2,3-dihydro-1H-inden-5-yl-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: indan-5-yl-(4-p-anisylpiperazin-4-ium-1-yl)methanone Formula: C22H27N2O2+ MolecularWeight: 351.46198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O2/c1-26-21-9-5-17(6-10-21)16-23-11-13-24(14-12-23)22(25)20-8-7-18-3-2-4-19(18)15-20/h5-10,15H,2-4,11-14,16H2,1H3/p+1