[(2R)-3-[4-[2-(4-methylphenoxy)ethanoyl]piperazin-1-yl]-2-oxidanyl-propyl]azanium

Systemtic Name: [(2R)-3-[4-[2-(4-methylphenoxy)ethanoyl]piperazin-1-yl]-2-oxidanyl-propyl]azanium Openeye Name: [(2R)-2-hydroxy-3-[4-[2-(4-methylphenoxy)acetyl]piperazin-1-yl]propyl]ammonium CAS Name: [(2R)-2-hydroxy-3-[4-[2-(4-methylphenoxy)-1-oxoethyl]-1-piperazinyl]propyl]ammonium IUPAC Name: [(2R)-2-hydroxy-3-[4-[2-(4-methylphenoxy)acetyl]piperazin-1-yl]propyl]azanium Traditional Name: [(2R)-2-hydroxy-3-[4-[2-(4-methylphenoxy)acetyl]piperazino]propyl]ammonium Formula: C16H26N3O3+ MolecularWeight: 308.39594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(=O)N2CCN(CC2)CC(C[NH3+])O

Isomeric SMILES

CC1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C[C@@H](C[NH3+])O

InChI

InChI=1S/C16H25N3O3/c1-13-2-4-15(5-3-13)22-12-16(21)19-8-6-18(7-9-19)11-14(20)10-17/h2-5,14,20H,6-12,17H2,1H3/p+1/t14-/m1/s1