(3R)-4-cyclopentyl-3-[2-[4-(4-methylphenoxy)piperidin-1-yl]-2-oxidanylidene-ethyl]piperazin-4-ium-2-one

Systemtic Name: (3R)-4-cyclopentyl-3-[2-[4-(4-methylphenoxy)piperidin-1-yl]-2-oxidanylidene-ethyl]piperazin-4-ium-2-one Openeye Name: (3R)-4-cyclopentyl-3-[2-[4-(4-methylphenoxy)-1-piperidyl]-2-oxo-ethyl]piperazin-4-ium-2-one CAS Name: (3R)-4-cyclopentyl-3-[2-[4-(4-methylphenoxy)-1-piperidinyl]-2-oxoethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-4-cyclopentyl-3-[2-[4-(4-methylphenoxy)piperidin-1-yl]-2-oxoethyl]piperazin-4-ium-2-one Traditional Name: (3R)-4-cyclopentyl-3-[2-keto-2-[4-(4-methylphenoxy)piperidino]ethyl]piperazin-4-ium-2-one Formula: C23H34N3O3+ MolecularWeight: 400.53436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2CCN(CC2)C(=O)CC3C(=O)NCC[NH+]3C4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)OC2CCN(CC2)C(=O)C[C@@H]3C(=O)NCC[NH+]3C4CCCC4

InChI

InChI=1S/C23H33N3O3/c1-17-6-8-19(9-7-17)29-20-10-13-25(14-11-20)22(27)16-21-23(28)24-12-15-26(21)18-4-2-3-5-18/h6-9,18,20-21H,2-5,10-16H2,1H3,(H,24,28)/p+1/t21-/m1/s1