(diphenylmethyl) 2-[2-(3-bromanyl-2-oxidanyl-propoxy)-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]-3-methyl-but-2-enoate

Systemtic Name: (diphenylmethyl) 2-[2-(3-bromanyl-2-oxidanyl-propoxy)-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]-3-methyl-but-2-enoate Openeye Name: benzhydryl 2-[2-(3-bromo-2-hydroxy-propoxy)-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]-3-methyl-but-2-enoate CAS Name: 2-[2-(3-bromo-2-hydroxypropoxy)-4-oxo-3-[(1-oxo-2-phenylethyl)amino]-1-azetidinyl]-3-methyl-2-butenoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 2-[2-(3-bromo-2-hydroxypropoxy)-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]-3-methylbut-2-enoate Traditional Name: 2-[2-(3-bromo-2-hydroxy-propoxy)-4-keto-3-[(2-phenylacetyl)amino]azetidin-1-yl]-3-methyl-but-2-enoic acid benzhydryl ester Formula: C32H33BrN2O6 MolecularWeight: 621.51822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2)N3C(C(C3=O)NC(=O)CC4=CC=CC=C4)OCC(CBr)O)C

Isomeric SMILES

CC(=C(C(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2)N3C(C(C3=O)NC(=O)CC4=CC=CC=C4)OCC(CBr)O)C

InChI

InChI=1S/C32H33BrN2O6/c1-21(2)28(32(39)41-29(23-14-8-4-9-15-23)24-16-10-5-11-17-24)35-30(38)27(31(35)40-20-25(36)19-33)34-26(37)18-22-12-6-3-7-13-22/h3-17,25,27,29,31,36H,18-20H2,1-2H3,(H,34,37)