(3R)-4-[(2-ethoxyphenyl)methyl]-3-[2-oxidanylidene-2-(4-oxidanylpiperidin-1-yl)ethyl]piperazin-4-ium-2-one

Systemtic Name: (3R)-4-[(2-ethoxyphenyl)methyl]-3-[2-oxidanylidene-2-(4-oxidanylpiperidin-1-yl)ethyl]piperazin-4-ium-2-one Openeye Name: (3R)-4-[(2-ethoxyphenyl)methyl]-3-[2-(4-hydroxy-1-piperidyl)-2-oxo-ethyl]piperazin-4-ium-2-one CAS Name: (3R)-4-[(2-ethoxyphenyl)methyl]-3-[2-(4-hydroxy-1-piperidinyl)-2-oxoethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-4-[(2-ethoxyphenyl)methyl]-3-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]piperazin-4-ium-2-one Traditional Name: (3R)-4-(2-ethoxybenzyl)-3-[2-(4-hydroxypiperidino)-2-keto-ethyl]piperazin-4-ium-2-one Formula: C20H30N3O4+ MolecularWeight: 376.4699

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C[NH+]2CCNC(=O)C2CC(=O)N3CCC(CC3)O

Isomeric SMILES

CCOC1=CC=CC=C1C[NH+]2CCNC(=O)[C@H]2CC(=O)N3CCC(CC3)O

InChI

InChI=1S/C20H29N3O4/c1-2-27-18-6-4-3-5-15(18)14-23-12-9-21-20(26)17(23)13-19(25)22-10-7-16(24)8-11-22/h3-6,16-17,24H,2,7-14H2,1H3,(H,21,26)/p+1/t17-/m1/s1