6-phenylhexyl 2-[2-oxidanylidene-4-(phenylmethyl)sulfonyl-azetidin-1-yl]ethanoate

Systemtic Name: 6-phenylhexyl 2-[2-oxidanylidene-4-(phenylmethyl)sulfonyl-azetidin-1-yl]ethanoate Openeye Name: 6-phenylhexyl 2-(2-benzylsulfonyl-4-oxo-azetidin-1-yl)acetate CAS Name: 2-[2-oxo-4-(phenylmethyl)sulfonyl-1-azetidinyl]acetic acid 6-phenylhexyl ester IUPAC Name: 6-phenylhexyl 2-(2-benzylsulfonyl-4-oxoazetidin-1-yl)acetate Traditional Name: 2-(2-benzylsulfonyl-4-keto-azetidin-1-yl)acetic acid 6-phenylhexyl ester Formula: C24H29NO5S MolecularWeight: 443.55576

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C1=O)CC(=O)OCCCCCCC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1C(N(C1=O)CC(=O)OCCCCCCC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C24H29NO5S/c26-22-17-23(31(28,29)19-21-14-8-4-9-15-21)25(22)18-24(27)30-16-10-2-1-5-11-20-12-6-3-7-13-20/h3-4,6-9,12-15,23H,1-2,5,10-11,16-19H2