1-(5-methoxy-1H-indol-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone

Systemtic Name: 1-(5-methoxy-1H-indol-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-(5-methoxy-1H-indol-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone CAS Name: 1-(5-methoxy-1H-indol-3-yl)-2-(4-phenyl-1-piperazin-1-iumyl)ethanone IUPAC Name: 1-(5-methoxy-1H-indol-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Traditional Name: 1-(5-methoxy-1H-indol-3-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Formula: C21H24N3O2+ MolecularWeight: 350.43416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2/c1-26-17-7-8-20-18(13-17)19(14-22-20)21(25)15-23-9-11-24(12-10-23)16-5-3-2-4-6-16/h2-8,13-14,22H,9-12,15H2,1H3/p+1