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

Systemtic Name: 1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]piperidin-1-ium-4-one Openeye Name: 1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]piperidin-1-ium-4-one CAS Name: 1-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-4-piperidin-1-iumone IUPAC Name: 1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]piperidin-1-ium-4-one Traditional Name: 1-[2-keto-2-[4-(4-methoxyphenyl)piperazino]ethyl]piperidin-1-ium-4-one Formula: C18H26N3O3+ MolecularWeight: 332.41734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C[NH+]3CCC(=O)CC3

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C[NH+]3CCC(=O)CC3

InChI

InChI=1S/C18H25N3O3/c1-24-17-4-2-15(3-5-17)20-10-12-21(13-11-20)18(23)14-19-8-6-16(22)7-9-19/h2-5H,6-14H2,1H3/p+1