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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C[NH+]2CCNC(=O)C2CC(=O)N3CCC(CC3)O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C[NH+]2CCNC(=O)[C@H]2CC(=O)N3CCC(CC3)O)OC

InChI

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