(phenylmethyl) 2-[2-(2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)ethanoyl]pentanoate

Systemtic Name: (phenylmethyl) 2-[2-(2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)ethanoyl]pentanoate Openeye Name: benzyl 2-[2-(2-methylsulfanyl-4-oxo-azetidin-1-yl)acetyl]pentanoate CAS Name: 2-[2-[2-(methylthio)-4-oxo-1-azetidinyl]-1-oxoethyl]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(2-methylsulfanyl-4-oxoazetidin-1-yl)acetyl]pentanoate Traditional Name: 2-[2-[2-keto-4-(methylthio)azetidin-1-yl]acetyl]valeric acid benzyl ester Formula: C18H23NO4S MolecularWeight: 349.44452

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)CN1C(CC1=O)SC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCC(C(=O)CN1C(CC1=O)SC)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H23NO4S/c1-3-7-14(15(20)11-19-16(21)10-17(19)24-2)18(22)23-12-13-8-5-4-6-9-13/h4-6,8-9,14,17H,3,7,10-12H2,1-2H3