2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-3-methyl-3-[3-(oxiran-2-ylmethylamino)propyl]-1,3-thiazolidin-3-ium-4-one

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-3-methyl-3-[3-(oxiran-2-ylmethylamino)propyl]-1,3-thiazolidin-3-ium-4-one Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-3-methyl-3-[3-(oxiran-2-ylmethylamino)propyl]thiazolidin-3-ium-4-one CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-3-methyl-3-[3-(2-oxiranylmethylamino)propyl]-4-thiazolidin-3-iumone IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-3-methyl-3-[3-(oxiran-2-ylmethylamino)propyl]-1,3-thiazolidin-3-ium-4-one Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-3-[3-(glycidylamino)propyl]-3-methyl-thiazolidin-3-ium-4-one Formula: C24H39N2O3S+ MolecularWeight: 435.64306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2[N+](C(=O)CS2)(C)CCCNCC3CO3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2[N+](C(=O)CS2)(C)CCCNCC3CO3

InChI

InChI=1S/C24H38N2O3S/c1-23(2,3)18-11-16(12-19(21(18)28)24(4,5)6)22-26(7,20(27)15-30-22)10-8-9-25-13-17-14-29-17/h11-12,17,22,25H,8-10,13-15H2,1-7H3/p+1