(3,5-dimethoxyphenyl)-[4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (3,5-dimethoxyphenyl)-[4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (3,5-dimethoxyphenyl)-[4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (3,5-dimethoxyphenyl)-[4-(1H-indol-3-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (3,5-dimethoxyphenyl)-[4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (3,5-dimethoxyphenyl)-[4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]methanone Formula: C22H26N3O3+ MolecularWeight: 380.46014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CNC4=CC=CC=C43)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CNC4=CC=CC=C43)OC

InChI

InChI=1S/C22H25N3O3/c1-27-18-11-16(12-19(13-18)28-2)22(26)25-9-7-24(8-10-25)15-17-14-23-21-6-4-3-5-20(17)21/h3-6,11-14,23H,7-10,15H2,1-2H3/p+1