1-[2-[(3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-2-oxidanylidene-ethyl]piperidin-2-one

Systemtic Name: 1-[2-[(3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-2-oxidanylidene-ethyl]piperidin-2-one Openeye Name: 1-[2-[(3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-piperidyl]-2-oxo-ethyl]piperidin-2-one CAS Name: 1-[2-[(3S)-3-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-1-piperidinyl]-2-oxoethyl]-2-piperidinone IUPAC Name: 1-[2-[(3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-2-oxoethyl]piperidin-2-one Traditional Name: 1-[2-keto-2-[(3S)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidino]ethyl]-2-piperidone Formula: C23H35N4O3+ MolecularWeight: 415.549

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)C3CCCN(C3)C(=O)CN4CCCCC4=O

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)[C@H]3CCCN(C3)C(=O)CN4CCCCC4=O

InChI

InChI=1S/C23H34N4O3/c1-30-21-9-3-2-8-20(21)25-15-13-24(14-16-25)19-7-6-12-26(17-19)23(29)18-27-11-5-4-10-22(27)28/h2-3,8-9,19H,4-7,10-18H2,1H3/p+1/t19-/m0/s1