3-bromanyl-1-(6-phenylhexyl)-4-(phenylmethyl)sulfinyl-azetidin-2-one

Systemtic Name: 3-bromanyl-1-(6-phenylhexyl)-4-(phenylmethyl)sulfinyl-azetidin-2-one Openeye Name: 4-benzylsulfinyl-3-bromo-1-(6-phenylhexyl)azetidin-2-one CAS Name: 3-bromo-1-(6-phenylhexyl)-4-(phenylmethyl)sulfinyl-2-azetidinone IUPAC Name: 4-benzylsulfinyl-3-bromo-1-(6-phenylhexyl)azetidin-2-one Traditional Name: 4-benzylsulfinyl-3-bromo-1-(6-phenylhexyl)azetidin-2-one Formula: C22H26BrNO2S MolecularWeight: 448.41634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCN2C(C(C2=O)Br)S(=O)CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCN2C(C(C2=O)Br)S(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H26BrNO2S/c23-20-21(25)24(22(20)27(26)17-19-14-8-4-9-15-19)16-10-2-1-5-11-18-12-6-3-7-13-18/h3-4,6-9,12-15,20,22H,1-2,5,10-11,16-17H2