[4-oxidanyl-1,4-bis(oxidanylidene)-1-(2-phenoxyethoxy)butan-2-yl]-(phenylmethyl)azanium

Systemtic Name: [4-oxidanyl-1,4-bis(oxidanylidene)-1-(2-phenoxyethoxy)butan-2-yl]-(phenylmethyl)azanium Openeye Name: benzyl-[3-hydroxy-3-oxo-1-(2-phenoxyethoxycarbonyl)propyl]ammonium CAS Name: [4-hydroxy-1,4-dioxo-1-(2-phenoxyethoxy)butan-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[4-hydroxy-1,4-dioxo-1-(2-phenoxyethoxy)butan-2-yl]azanium Traditional Name: benzyl-[3-hydroxy-3-keto-1-(2-phenoxyethoxycarbonyl)propyl]ammonium Formula: C19H22NO5+ MolecularWeight: 344.38168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]C(CC(=O)O)C(=O)OCCOC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+]C(CC(=O)O)C(=O)OCCOC2=CC=CC=C2

InChI

InChI=1S/C19H21NO5/c21-18(22)13-17(20-14-15-7-3-1-4-8-15)19(23)25-12-11-24-16-9-5-2-6-10-16/h1-10,17,20H,11-14H2,(H,21,22)/p+1