tert-butyl 2-[[2-(naphthalen-1-ylmethyl)-3-(oxiran-2-ylmethylsulfonyl)propanoyl]amino]hexanoate

Systemtic Name: tert-butyl 2-[[2-(naphthalen-1-ylmethyl)-3-(oxiran-2-ylmethylsulfonyl)propanoyl]amino]hexanoate Openeye Name: tert-butyl 2-[[2-(1-naphthylmethyl)-3-(oxiran-2-ylmethylsulfonyl)propanoyl]amino]hexanoate CAS Name: 2-[[2-(1-naphthalenylmethyl)-3-(2-oxiranylmethylsulfonyl)-1-oxopropyl]amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-(naphthalen-1-ylmethyl)-3-(oxiran-2-ylmethylsulfonyl)propanoyl]amino]hexanoate Traditional Name: 2-[[2-(glycidylsulfonylmethyl)-3-(1-naphthyl)propanoyl]amino]hexanoic acid tert-butyl ester Formula: C27H37NO6S MolecularWeight: 503.65078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC(C)(C)C)NC(=O)C(CC1=CC=CC2=CC=CC=C21)CS(=O)(=O)CC3CO3

Isomeric SMILES

CCCCC(C(=O)OC(C)(C)C)NC(=O)C(CC1=CC=CC2=CC=CC=C21)CS(=O)(=O)CC3CO3

InChI

InChI=1S/C27H37NO6S/c1-5-6-14-24(26(30)34-27(2,3)4)28-25(29)21(17-35(31,32)18-22-16-33-22)15-20-12-9-11-19-10-7-8-13-23(19)20/h7-13,21-22,24H,5-6,14-18H2,1-4H3,(H,28,29)