N-methyl-3-oxidanyl-3-oxidanylidene-N-[3-[4-(phenylmethyl)phenoxy]propyl]propan-1-amine oxide

Systemtic Name: N-methyl-3-oxidanyl-3-oxidanylidene-N-[3-[4-(phenylmethyl)phenoxy]propyl]propan-1-amine oxide Openeye Name: N-[3-(4-benzylphenoxy)propyl]-3-hydroxy-N-methyl-3-oxo-propan-1-amine oxide CAS Name: 3-hydroxy-N-methyl-3-oxo-N-[3-[4-(phenylmethyl)phenoxy]propyl]-1-propanamine oxide IUPAC Name: N-[3-(4-benzylphenoxy)propyl]-3-hydroxy-N-methyl-3-oxopropan-1-amine oxide Traditional Name: N-[3-(4-benzylphenoxy)propyl]-3-hydroxy-3-keto-N-methyl-propan-1-amine oxide Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CCCOC1=CC=C(C=C1)CC2=CC=CC=C2)(CCC(=O)O)[O-]

Isomeric SMILES

C[N+](CCCOC1=CC=C(C=C1)CC2=CC=CC=C2)(CCC(=O)O)[O-]

InChI

InChI=1S/C20H25NO4/c1-21(24,14-12-20(22)23)13-5-15-25-19-10-8-18(9-11-19)16-17-6-3-2-4-7-17/h2-4,6-11H,5,12-16H2,1H3,(H,22,23)