tert-butyl 4-[3,3-diethyl-1-[(4-iodophenyl)methylcarbamoyl]-4-oxidanylidene-azetidin-2-yl]oxybenzoate

Systemtic Name: tert-butyl 4-[3,3-diethyl-1-[(4-iodophenyl)methylcarbamoyl]-4-oxidanylidene-azetidin-2-yl]oxybenzoate Openeye Name: tert-butyl 4-[3,3-diethyl-1-[(4-iodophenyl)methylcarbamoyl]-4-oxo-azetidin-2-yl]oxybenzoate CAS Name: 4-[[3,3-diethyl-1-[[(4-iodophenyl)methylamino]-oxomethyl]-4-oxo-2-azetidinyl]oxy]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3,3-diethyl-1-[(4-iodophenyl)methylcarbamoyl]-4-oxoazetidin-2-yl]oxybenzoate Traditional Name: 4-[3,3-diethyl-1-[(4-iodobenzyl)carbamoyl]-4-keto-azetidin-2-yl]oxybenzoic acid tert-butyl ester Formula: C26H31IN2O5 MolecularWeight: 578.43921

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31IN2O5/c1-6-26(7-2)22(31)29(24(32)28-16-17-8-12-19(27)13-9-17)23(26)33-20-14-10-18(11-15-20)21(30)34-25(3,4)5/h8-15,23H,6-7,16H2,1-5H3,(H,28,32)