1-[4-[(2R)-3-[(4-methoxyphenyl)methoxy]-2-oxidanyl-propyl]piperazin-4-ium-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[(2R)-3-[(4-methoxyphenyl)methoxy]-2-oxidanyl-propyl]piperazin-4-ium-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[(2R)-2-hydroxy-3-[(4-methoxyphenyl)methoxy]propyl]piperazin-4-ium-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[(2R)-2-hydroxy-3-[(4-methoxyphenyl)methoxy]propyl]-1-piperazin-4-iumyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[(2R)-2-hydroxy-3-[(4-methoxyphenyl)methoxy]propyl]piperazin-4-ium-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[(2R)-2-hydroxy-3-p-anisyloxy-propyl]piperazin-4-ium-1-yl]-2-methyl-propan-1-one Formula: C19H31N2O4+ MolecularWeight: 351.46044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CC[NH+](CC1)CC(COCC2=CC=C(C=C2)OC)O

Isomeric SMILES

CC(C)C(=O)N1CC[NH+](CC1)C[C@H](COCC2=CC=C(C=C2)OC)O

InChI

InChI=1S/C19H30N2O4/c1-15(2)19(23)21-10-8-20(9-11-21)12-17(22)14-25-13-16-4-6-18(24-3)7-5-16/h4-7,15,17,22H,8-14H2,1-3H3/p+1/t17-/m1/s1