(2,3-dimethoxyphenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (2,3-dimethoxyphenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Openeye Name: (2,3-dimethoxyphenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone CAS Name: (2,3-dimethoxyphenyl)-(4-phenethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (2,3-dimethoxyphenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Traditional Name: (2,3-dimethoxyphenyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1OC)C(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3/c1-25-19-10-6-9-18(20(19)26-2)21(24)23-15-13-22(14-16-23)12-11-17-7-4-3-5-8-17/h3-10H,11-16H2,1-2H3/p+1