4-[3,3-diethyl-4-oxidanylidene-1-(3-phenoxypropylcarbamoyl)azetidin-2-yl]oxybenzoic acid

Systemtic Name: 4-[3,3-diethyl-4-oxidanylidene-1-(3-phenoxypropylcarbamoyl)azetidin-2-yl]oxybenzoic acid Openeye Name: 4-[3,3-diethyl-4-oxo-1-(3-phenoxypropylcarbamoyl)azetidin-2-yl]oxybenzoic acid CAS Name: 4-[[3,3-diethyl-4-oxo-1-[oxo-(3-phenoxypropylamino)methyl]-2-azetidinyl]oxy]benzoic acid IUPAC Name: 4-[3,3-diethyl-4-oxo-1-(3-phenoxypropylcarbamoyl)azetidin-2-yl]oxybenzoic acid Traditional Name: 4-[3,3-diethyl-4-keto-1-(3-phenoxypropylcarbamoyl)azetidin-2-yl]oxybenzoic acid Formula: C24H28N2O6 MolecularWeight: 440.48892

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N(C1=O)C(=O)NCCCOC2=CC=CC=C2)OC3=CC=C(C=C3)C(=O)O)CC

Isomeric SMILES

CCC1(C(N(C1=O)C(=O)NCCCOC2=CC=CC=C2)OC3=CC=C(C=C3)C(=O)O)CC

InChI

InChI=1S/C24H28N2O6/c1-3-24(4-2)21(29)26(22(24)32-19-13-11-17(12-14-19)20(27)28)23(30)25-15-8-16-31-18-9-6-5-7-10-18/h5-7,9-14,22H,3-4,8,15-16H2,1-2H3,(H,25,30)(H,27,28)