[(2S,3S)-3-methyl-3-[4-methyl-3-(naphthalen-1-ylcarbamoyloxy)-4-oxidanyl-pentyl]oxiran-2-yl]methyl methanesulfonate

Systemtic Name: [(2S,3S)-3-methyl-3-[4-methyl-3-(naphthalen-1-ylcarbamoyloxy)-4-oxidanyl-pentyl]oxiran-2-yl]methyl methanesulfonate Openeye Name: [(2S,3S)-3-[4-hydroxy-4-methyl-3-(1-naphthylcarbamoyloxy)pentyl]-3-methyl-oxiran-2-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [(2S,3S)-3-[4-hydroxy-4-methyl-3-[(1-naphthalenylamino)-oxomethoxy]pentyl]-3-methyl-2-oxiranyl]methyl ester IUPAC Name: [(2S,3S)-3-[4-hydroxy-4-methyl-3-(naphthalen-1-ylcarbamoyloxy)pentyl]-3-methyloxiran-2-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [(2S,3S)-3-[4-hydroxy-4-methyl-3-(1-naphthylcarbamoyloxy)pentyl]-3-methyl-oxiran-2-yl]methyl ester Formula: C22H29NO7S MolecularWeight: 451.53316

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(O1)COS(=O)(=O)C)CCC(C(C)(C)O)OC(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

C[C@@]1([C@@H](O1)COS(=O)(=O)C)CCC(C(C)(C)O)OC(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C22H29NO7S/c1-21(2,25)18(12-13-22(3)19(30-22)14-28-31(4,26)27)29-20(24)23-17-11-7-9-15-8-5-6-10-16(15)17/h5-11,18-19,25H,12-14H2,1-4H3,(H,23,24)/t18?,19-,22-/m0/s1