dibutyl-[(2R)-2-oxidanyl-3-[2-(phenylcarbamoyl)phenoxy]propyl]azanium

Systemtic Name: dibutyl-[(2R)-2-oxidanyl-3-[2-(phenylcarbamoyl)phenoxy]propyl]azanium Openeye Name: dibutyl-[(2R)-2-hydroxy-3-[2-(phenylcarbamoyl)phenoxy]propyl]ammonium CAS Name: [(2R)-3-[2-[anilino(oxo)methyl]phenoxy]-2-hydroxypropyl]-dibutylammonium IUPAC Name: dibutyl-[(2R)-2-hydroxy-3-[2-(phenylcarbamoyl)phenoxy]propyl]azanium Traditional Name: dibutyl-[(2R)-2-hydroxy-3-[2-(phenylcarbamoyl)phenoxy]propyl]ammonium Formula: C24H35N2O3+ MolecularWeight: 399.5463

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC(COC1=CC=CC=C1C(=O)NC2=CC=CC=C2)O

Isomeric SMILES

CCCC[NH+](CCCC)C[C@H](COC1=CC=CC=C1C(=O)NC2=CC=CC=C2)O

InChI

InChI=1S/C24H34N2O3/c1-3-5-16-26(17-6-4-2)18-21(27)19-29-23-15-11-10-14-22(23)24(28)25-20-12-8-7-9-13-20/h7-15,21,27H,3-6,16-19H2,1-2H3,(H,25,28)/p+1/t21-/m1/s1