1-(6-methoxy-1H-indol-3-yl)-2-[(3S)-3-methyl-4-(3-methylphenyl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-(6-methoxy-1H-indol-3-yl)-2-[(3S)-3-methyl-4-(3-methylphenyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-(6-methoxy-1H-indol-3-yl)-2-[(3S)-3-methyl-4-(m-tolyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-(6-methoxy-1H-indol-3-yl)-2-[(3S)-3-methyl-4-(3-methylphenyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-(6-methoxy-1H-indol-3-yl)-2-[(3S)-3-methyl-4-(3-methylphenyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-(6-methoxy-1H-indol-3-yl)-2-[(3S)-3-methyl-4-(m-tolyl)piperazin-1-ium-1-yl]ethanone Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CCN1C2=CC=CC(=C2)C)CC(=O)C3=CNC4=C3C=CC(=C4)OC

Isomeric SMILES

C[C@H]1C[NH+](CCN1C2=CC=CC(=C2)C)CC(=O)C3=CNC4=C3C=CC(=C4)OC

InChI

InChI=1S/C23H27N3O2/c1-16-5-4-6-18(11-16)26-10-9-25(14-17(26)2)15-23(27)21-13-24-22-12-19(28-3)7-8-20(21)22/h4-8,11-13,17,24H,9-10,14-15H2,1-3H3/p+1/t17-/m0/s1