4-[3-(1-cyclopentylpiperidin-1-ium-4-yl)oxyphenyl]carbonyl-3,3-dimethyl-piperazin-2-one

Systemtic Name: 4-[3-(1-cyclopentylpiperidin-1-ium-4-yl)oxyphenyl]carbonyl-3,3-dimethyl-piperazin-2-one Openeye Name: 4-[3-(1-cyclopentylpiperidin-1-ium-4-yl)oxybenzoyl]-3,3-dimethyl-piperazin-2-one CAS Name: 4-[[3-[(1-cyclopentyl-4-piperidin-1-iumyl)oxy]phenyl]-oxomethyl]-3,3-dimethyl-2-piperazinone IUPAC Name: 4-[3-(1-cyclopentylpiperidin-1-ium-4-yl)oxybenzoyl]-3,3-dimethylpiperazin-2-one Traditional Name: 4-[3-(1-cyclopentylpiperidin-1-ium-4-yl)oxybenzoyl]-3,3-dimethyl-piperazin-2-one Formula: C23H34N3O3+ MolecularWeight: 400.53436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NCCN1C(=O)C2=CC(=CC=C2)OC3CC[NH+](CC3)C4CCCC4)C

Isomeric SMILES

CC1(C(=O)NCCN1C(=O)C2=CC(=CC=C2)OC3CC[NH+](CC3)C4CCCC4)C

InChI

InChI=1S/C23H33N3O3/c1-23(2)22(28)24-12-15-26(23)21(27)17-6-5-9-20(16-17)29-19-10-13-25(14-11-19)18-7-3-4-8-18/h5-6,9,16,18-19H,3-4,7-8,10-15H2,1-2H3,(H,24,28)/p+1