3-indol-1-yl-1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 3-indol-1-yl-1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one Openeye Name: 3-indol-1-yl-1-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]propan-1-one CAS Name: 3-(1-indolyl)-1-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 3-indol-1-yl-1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one Traditional Name: 3-indol-1-yl-1-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]propan-1-one Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)CCN3C=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)CCN3C=CC4=CC=CC=C43

InChI

InChI=1S/C23H27N3O/c1-19-6-2-3-8-21(19)18-24-14-16-26(17-15-24)23(27)11-13-25-12-10-20-7-4-5-9-22(20)25/h2-10,12H,11,13-18H2,1H3/p+1