2-[[5,5-dimethyl-2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]carbonyl]hexyl-phenylmethoxy-azanium

Systemtic Name: 2-[[5,5-dimethyl-2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]carbonyl]hexyl-phenylmethoxy-azanium Openeye Name: 2-(4-benzyl-5,5-dimethyl-2-oxo-oxazolidine-3-carbonyl)hexyl-benzyloxy-ammonium CAS Name: 2-[[5,5-dimethyl-2-oxo-4-(phenylmethyl)-3-oxazolidinyl]-oxomethyl]hexyl-phenylmethoxyammonium IUPAC Name: 2-(4-benzyl-5,5-dimethyl-2-oxo-1,3-oxazolidine-3-carbonyl)hexyl-phenylmethoxyazanium Traditional Name: benzoxy-[2-(4-benzyl-2-keto-5,5-dimethyl-oxazolidine-3-carbonyl)hexyl]ammonium Formula: C26H35N2O4+ MolecularWeight: 439.5671

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C[NH2+]OCC1=CC=CC=C1)C(=O)N2C(C(OC2=O)(C)C)CC3=CC=CC=C3

Isomeric SMILES

CCCCC(C[NH2+]OCC1=CC=CC=C1)C(=O)N2C(C(OC2=O)(C)C)CC3=CC=CC=C3

InChI

InChI=1S/C26H34N2O4/c1-4-5-16-22(18-27-31-19-21-14-10-7-11-15-21)24(29)28-23(26(2,3)32-25(28)30)17-20-12-8-6-9-13-20/h6-15,22-23,27H,4-5,16-19H2,1-3H3/p+1