(3,4-dimethoxyphenyl)-[4-(naphthalen-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (3,4-dimethoxyphenyl)-[4-(naphthalen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (3,4-dimethoxyphenyl)-[4-(2-naphthylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (3,4-dimethoxyphenyl)-[4-(2-naphthalenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (3,4-dimethoxyphenyl)-[4-(naphthalen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (3,4-dimethoxyphenyl)-[4-(2-naphthylmethyl)piperazin-4-ium-1-yl]methanone Formula: C24H27N2O3+ MolecularWeight: 391.48278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=CC4=CC=CC=C4C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=CC4=CC=CC=C4C=C3)OC

InChI

InChI=1S/C24H26N2O3/c1-28-22-10-9-21(16-23(22)29-2)24(27)26-13-11-25(12-14-26)17-18-7-8-19-5-3-4-6-20(19)15-18/h3-10,15-16H,11-14,17H2,1-2H3/p+1