(4-nitrophenyl)methyl 2-[2-acetamidosulfinamoyl-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]-3-methyl-but-3-enoate

Systemtic Name: (4-nitrophenyl)methyl 2-[2-acetamidosulfinamoyl-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: (4-nitrophenyl)methyl 2-[2-acetamidosulfinamoyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[2-acetamidosulfinamoyl-4-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-1-azetidinyl]-3-methyl-3-butenoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[2-acetamidosulfinamoyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-[2-acetamidosulfinamoyl-4-keto-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methyl-but-3-enoic acid (4-nitrobenzyl) ester Formula: C25H27N5O9S MolecularWeight: 573.57498

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N2C(C(C2=O)NC(=O)COC3=CC=CC=C3)S(=O)NNC(=O)C

Isomeric SMILES

CC(=C)C(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N2C(C(C2=O)NC(=O)COC3=CC=CC=C3)S(=O)NNC(=O)C

InChI

InChI=1S/C25H27N5O9S/c1-15(2)22(25(34)39-13-17-9-11-18(12-10-17)30(35)36)29-23(33)21(24(29)40(37)28-27-16(3)31)26-20(32)14-38-19-7-5-4-6-8-19/h4-12,21-22,24,28H,1,13-14H2,2-3H3,(H,26,32)(H,27,31)