methyl (E)-4-bromanyl-3-methyl-2-[(2R,3S)-2-oxidanyl-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]but-2-enoate

Systemtic Name: methyl (E)-4-bromanyl-3-methyl-2-[(2R,3S)-2-oxidanyl-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]but-2-enoate Openeye Name: methyl (E)-4-bromo-2-[(2R,3S)-2-hydroxy-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]-3-methyl-but-2-enoate CAS Name: (E)-4-bromo-2-[(2R,3S)-2-hydroxy-4-oxo-3-[(1-oxo-2-phenylethyl)amino]-1-azetidinyl]-3-methyl-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-bromo-2-[(2R,3S)-2-hydroxy-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]-3-methylbut-2-enoate Traditional Name: (E)-4-bromo-2-[(2R,3S)-2-hydroxy-4-keto-3-[(2-phenylacetyl)amino]azetidin-1-yl]-3-methyl-but-2-enoic acid methyl ester Formula: C17H19BrN2O5 MolecularWeight: 411.24716

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OC)N1C(C(C1=O)NC(=O)CC2=CC=CC=C2)O)CBr

Isomeric SMILES

C/C(=C(/C(=O)OC)\N1[C@@H]([C@@H](C1=O)NC(=O)CC2=CC=CC=C2)O)/CBr

InChI

InChI=1S/C17H19BrN2O5/c1-10(9-18)14(17(24)25-2)20-15(22)13(16(20)23)19-12(21)8-11-6-4-3-5-7-11/h3-7,13,15,22H,8-9H2,1-2H3,(H,19,21)/b14-10+/t13-,15+/m0/s1