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

Systemtic Name: (4-nitrophenyl)methyl 2-[2-methoxysulfinyl-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: (4-nitrophenyl)methyl 2-[2-methoxysulfinyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[2-methoxysulfinyl-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-methoxysulfinyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-[2-keto-4-methoxysulfinyl-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methyl-but-3-enoic acid (4-nitrobenzyl) ester Formula: C24H25N3O9S MolecularWeight: 531.535

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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)OC

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)OC

InChI

InChI=1S/C24H25N3O9S/c1-15(2)21(24(30)36-13-16-9-11-17(12-10-16)27(31)32)26-22(29)20(23(26)37(33)34-3)25-19(28)14-35-18-7-5-4-6-8-18/h4-12,20-21,23H,1,13-14H2,2-3H3,(H,25,28)