[4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-(2-methylpropyl)piperidin-1-ium-4-yl]methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-(2-methylpropyl)piperidin-1-ium-4-yl]methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(1-isobutylpiperidin-1-ium-4-yl)methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[1-(2-methylpropyl)-4-piperidin-1-iumyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-(2-methylpropyl)piperidin-1-ium-4-yl]methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-(1-isobutylpiperidin-1-ium-4-yl)methanone Formula: C22H36N3O+ MolecularWeight: 358.54074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3CC[NH+](CC3)CC(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3CC[NH+](CC3)CC(C)C)C

InChI

InChI=1S/C22H35N3O/c1-17(2)16-23-10-8-20(9-11-23)22(26)25-14-12-24(13-15-25)21-7-5-6-18(3)19(21)4/h5-7,17,20H,8-16H2,1-4H3/p+1