3-[4-[3,3-diethyl-4-oxidanylidene-1-[(phenylmethyl)carbamoyl]azetidin-2-yl]oxyphenyl]propanoic acid

Systemtic Name: 3-[4-[3,3-diethyl-4-oxidanylidene-1-[(phenylmethyl)carbamoyl]azetidin-2-yl]oxyphenyl]propanoic acid Openeye Name: 3-[4-[1-(benzylcarbamoyl)-3,3-diethyl-4-oxo-azetidin-2-yl]oxyphenyl]propanoic acid CAS Name: 3-[4-[[3,3-diethyl-4-oxo-1-[oxo-[(phenylmethyl)amino]methyl]-2-azetidinyl]oxy]phenyl]propanoic acid IUPAC Name: 3-[4-[1-(benzylcarbamoyl)-3,3-diethyl-4-oxoazetidin-2-yl]oxyphenyl]propanoic acid Traditional Name: 3-[4-[1-(benzylcarbamoyl)-3,3-diethyl-4-keto-azetidin-2-yl]oxyphenyl]propionic acid Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N(C1=O)C(=O)NCC2=CC=CC=C2)OC3=CC=C(C=C3)CCC(=O)O)CC

Isomeric SMILES

CCC1(C(N(C1=O)C(=O)NCC2=CC=CC=C2)OC3=CC=C(C=C3)CCC(=O)O)CC

InChI

InChI=1S/C24H28N2O5/c1-3-24(4-2)21(29)26(23(30)25-16-18-8-6-5-7-9-18)22(24)31-19-13-10-17(11-14-19)12-15-20(27)28/h5-11,13-14,22H,3-4,12,15-16H2,1-2H3,(H,25,30)(H,27,28)