2-(2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoyl)oxyethyl-dimethyl-[(3-oxidanylidene-1,2-benzoxazol-2-yl)methyl]azanium

Systemtic Name: 2-(2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoyl)oxyethyl-dimethyl-[(3-oxidanylidene-1,2-benzoxazol-2-yl)methyl]azanium Openeye Name: 2-(2-cyclopentyl-2-hydroxy-2-phenyl-acetyl)oxyethyl-dimethyl-[(3-oxo-1,2-benzoxazol-2-yl)methyl]ammonium CAS Name: 2-(2-cyclopentyl-2-hydroxy-1-oxo-2-phenylethoxy)ethyl-dimethyl-[(3-oxo-1,2-benzoxazol-2-yl)methyl]ammonium IUPAC Name: 2-(2-cyclopentyl-2-hydroxy-2-phenylacetyl)oxyethyl-dimethyl-[(3-oxo-1,2-benzoxazol-2-yl)methyl]azanium Traditional Name: 2-(2-cyclopentyl-2-hydroxy-2-phenyl-acetyl)oxyethyl-[(3-ketoindoxazen-2-yl)methyl]-dimethyl-ammonium Formula: C25H31N2O5+ MolecularWeight: 439.52404

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCOC(=O)C(C1CCCC1)(C2=CC=CC=C2)O)CN3C(=O)C4=CC=CC=C4O3

Isomeric SMILES

C[N+](C)(CCOC(=O)C(C1CCCC1)(C2=CC=CC=C2)O)CN3C(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C25H31N2O5/c1-27(2,18-26-23(28)21-14-8-9-15-22(21)32-26)16-17-31-24(29)25(30,20-12-6-7-13-20)19-10-4-3-5-11-19/h3-5,8-11,14-15,20,30H,6-7,12-13,16-18H2,1-2H3/q+1