1-(5-methoxy-1H-indol-3-yl)-2-[(3S)-4-(3-methoxyphenyl)-3-methyl-piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-(5-methoxy-1H-indol-3-yl)-2-[(3S)-4-(3-methoxyphenyl)-3-methyl-piperazin-1-ium-1-yl]ethanone Openeye Name: 1-(5-methoxy-1H-indol-3-yl)-2-[(3S)-4-(3-methoxyphenyl)-3-methyl-piperazin-1-ium-1-yl]ethanone CAS Name: 1-(5-methoxy-1H-indol-3-yl)-2-[(3S)-4-(3-methoxyphenyl)-3-methyl-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-(5-methoxy-1H-indol-3-yl)-2-[(3S)-4-(3-methoxyphenyl)-3-methylpiperazin-1-ium-1-yl]ethanone Traditional Name: 1-(5-methoxy-1H-indol-3-yl)-2-[(3S)-4-(3-methoxyphenyl)-3-methyl-piperazin-1-ium-1-yl]ethanone Formula: C23H28N3O3+ MolecularWeight: 394.48672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3/c1-16-14-25(9-10-26(16)17-5-4-6-18(11-17)28-2)15-23(27)21-13-24-22-8-7-19(29-3)12-20(21)22/h4-8,11-13,16,24H,9-10,14-15H2,1-3H3/p+1/t16-/m0/s1