(3,4-dimethoxyphenyl)-[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]methanone

Systemtic Name: (3,4-dimethoxyphenyl)-[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]methanone Openeye Name: (3,4-dimethoxyphenyl)-[4-(4-phenylpiperazin-1-ium-1-yl)-1-piperidyl]methanone CAS Name: (3,4-dimethoxyphenyl)-[4-(4-phenyl-1-piperazin-1-iumyl)-1-piperidinyl]methanone IUPAC Name: (3,4-dimethoxyphenyl)-[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]methanone Traditional Name: (3,4-dimethoxyphenyl)-[4-(4-phenylpiperazin-1-ium-1-yl)piperidino]methanone Formula: C24H32N3O3+ MolecularWeight: 410.52918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)[NH+]3CCN(CC3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)[NH+]3CCN(CC3)C4=CC=CC=C4)OC

InChI

InChI=1S/C24H31N3O3/c1-29-22-9-8-19(18-23(22)30-2)24(28)27-12-10-21(11-13-27)26-16-14-25(15-17-26)20-6-4-3-5-7-20/h3-9,18,21H,10-17H2,1-2H3/p+1