(4-methoxyphenyl)methyl 2-[3-bromanyl-2-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]sulfinyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-2-enoate

Systemtic Name: (4-methoxyphenyl)methyl 2-[3-bromanyl-2-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]sulfinyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-2-enoate Openeye Name: (4-methoxyphenyl)methyl 2-[3-bromo-2-[(E)-3-ethoxy-3-oxo-prop-1-enyl]sulfinyl-4-oxo-azetidin-1-yl]-3-methyl-but-2-enoate CAS Name: 2-[3-bromo-2-[(E)-3-ethoxy-3-oxoprop-1-enyl]sulfinyl-4-oxo-1-azetidinyl]-3-methyl-2-butenoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 2-[3-bromo-2-[(E)-3-ethoxy-3-oxoprop-1-enyl]sulfinyl-4-oxoazetidin-1-yl]-3-methylbut-2-enoate Traditional Name: 2-[3-bromo-2-[(E)-3-ethoxy-3-keto-prop-1-enyl]sulfinyl-4-keto-azetidin-1-yl]-3-methyl-but-2-enoic acid p-anisyl ester Formula: C21H24BrNO7S MolecularWeight: 514.38676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CS(=O)C1C(C(=O)N1C(=C(C)C)C(=O)OCC2=CC=C(C=C2)OC)Br

Isomeric SMILES

CCOC(=O)/C=C/S(=O)C1C(C(=O)N1C(=C(C)C)C(=O)OCC2=CC=C(C=C2)OC)Br

InChI

InChI=1S/C21H24BrNO7S/c1-5-29-16(24)10-11-31(27)20-17(22)19(25)23(20)18(13(2)3)21(26)30-12-14-6-8-15(28-4)9-7-14/h6-11,17,20H,5,12H2,1-4H3/b11-10+