methyl 2-[2-acetamido-4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]sulfanyl-1-oxidanidyl-azetidin-1-ium-1-yl]-3-methyl-but-3-enoate

Systemtic Name: methyl 2-[2-acetamido-4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]sulfanyl-1-oxidanidyl-azetidin-1-ium-1-yl]-3-methyl-but-3-enoate Openeye Name: methyl 2-[2-acetamido-4-(2,5-dioxopyrrolidin-1-yl)sulfanyl-1-oxido-azetidin-1-ium-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[2-acetamido-4-[(2,5-dioxo-1-pyrrolidinyl)thio]-1-oxido-1-azetidin-1-iumyl]-3-methyl-3-butenoic acid methyl ester IUPAC Name: methyl 2-[2-acetamido-4-(2,5-dioxopyrrolidin-1-yl)sulfanyl-1-oxidoazetidin-1-ium-1-yl]-3-methylbut-3-enoate Traditional Name: 2-[2-acetamido-1-oxido-4-(succinimidothio)azetidin-1-ium-1-yl]-3-methyl-but-3-enoic acid methyl ester Formula: C15H21N3O6S MolecularWeight: 371.40874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OC)[N+]1(C(CC1SN2C(=O)CCC2=O)NC(=O)C)[O-]

Isomeric SMILES

CC(=C)C(C(=O)OC)[N+]1(C(CC1SN2C(=O)CCC2=O)NC(=O)C)[O-]

InChI

InChI=1S/C15H21N3O6S/c1-8(2)14(15(22)24-4)18(23)10(16-9(3)19)7-13(18)25-17-11(20)5-6-12(17)21/h10,13-14H,1,5-7H2,2-4H3,(H,16,19)