[(2R)-3-[4-(3,4-dimethylphenyl)carbonylpiperazin-1-yl]-2-oxidanyl-propyl]azanium

Systemtic Name: [(2R)-3-[4-(3,4-dimethylphenyl)carbonylpiperazin-1-yl]-2-oxidanyl-propyl]azanium Openeye Name: [(2R)-3-[4-(3,4-dimethylbenzoyl)piperazin-1-yl]-2-hydroxy-propyl]ammonium CAS Name: [(2R)-3-[4-[(3,4-dimethylphenyl)-oxomethyl]-1-piperazinyl]-2-hydroxypropyl]ammonium IUPAC Name: [(2R)-3-[4-(3,4-dimethylbenzoyl)piperazin-1-yl]-2-hydroxypropyl]azanium Traditional Name: [(2R)-3-[4-(3,4-dimethylbenzoyl)piperazino]-2-hydroxy-propyl]ammonium Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O2/c1-12-3-4-14(9-13(12)2)16(21)19-7-5-18(6-8-19)11-15(20)10-17/h3-4,9,15,20H,5-8,10-11,17H2,1-2H3/p+1/t15-/m1/s1