2-chloranyl-2-[2-[2-(oxan-4-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]ethanoate

Systemtic Name: 2-chloranyl-2-[2-[2-(oxan-4-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]ethanoate Openeye Name: 2-chloro-2-[2-oxo-4-(2-oxo-2-tetrahydropyran-4-yl-ethyl)sulfanyl-3-[(2-phenylacetyl)amino]azetidin-1-yl]acetate CAS Name: 2-chloro-2-[2-[[2-(4-oxanyl)-2-oxoethyl]thio]-4-oxo-3-[(1-oxo-2-phenylethyl)amino]-1-azetidinyl]acetate IUPAC Name: 2-chloro-2-[2-[2-(oxan-4-yl)-2-oxoethyl]sulfanyl-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]acetate Traditional Name: 2-chloro-2-[2-keto-4-[(2-keto-2-tetrahydropyran-4-yl-ethyl)thio]-3-[(2-phenylacetyl)amino]azetidin-1-yl]acetate Formula: C20H22ClN2O6S- MolecularWeight: 453.91648

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C(=O)CSC2C(C(=O)N2C(C(=O)[O-])Cl)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1COCCC1C(=O)CSC2C(C(=O)N2C(C(=O)[O-])Cl)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H23ClN2O6S/c21-17(20(27)28)23-18(26)16(22-15(25)10-12-4-2-1-3-5-12)19(23)30-11-14(24)13-6-8-29-9-7-13/h1-5,13,16-17,19H,6-11H2,(H,22,25)(H,27,28)/p-1