tert-butyl 4-[3-ethyl-3-methyl-4-oxidanylidene-1-[(phenylmethyl)carbamoyl]azetidin-2-yl]oxybenzoate

Systemtic Name: tert-butyl 4-[3-ethyl-3-methyl-4-oxidanylidene-1-[(phenylmethyl)carbamoyl]azetidin-2-yl]oxybenzoate Openeye Name: tert-butyl 4-[1-(benzylcarbamoyl)-3-ethyl-3-methyl-4-oxo-azetidin-2-yl]oxybenzoate CAS Name: 4-[[3-ethyl-3-methyl-4-oxo-1-[oxo-[(phenylmethyl)amino]methyl]-2-azetidinyl]oxy]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(benzylcarbamoyl)-3-ethyl-3-methyl-4-oxoazetidin-2-yl]oxybenzoate Traditional Name: 4-[1-(benzylcarbamoyl)-3-ethyl-4-keto-3-methyl-azetidin-2-yl]oxybenzoic acid tert-butyl ester Formula: C25H30N2O5 MolecularWeight: 438.5161

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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)C(=O)OC(C)(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H30N2O5/c1-6-25(5)21(29)27(23(30)26-16-17-10-8-7-9-11-17)22(25)31-19-14-12-18(13-15-19)20(28)32-24(2,3)4/h7-15,22H,6,16H2,1-5H3,(H,26,30)