tert-butyl 2-[[2-(2-ethoxycarbonyloxyethylsulfonylmethyl)-3-naphthalen-1-yl-propanoyl]amino]hexanoate

Systemtic Name: tert-butyl 2-[[2-(2-ethoxycarbonyloxyethylsulfonylmethyl)-3-naphthalen-1-yl-propanoyl]amino]hexanoate Openeye Name: tert-butyl 2-[[2-(2-ethoxycarbonyloxyethylsulfonylmethyl)-3-(1-naphthyl)propanoyl]amino]hexanoate CAS Name: 2-[[2-(2-ethoxycarbonyloxyethylsulfonylmethyl)-3-(1-naphthalenyl)-1-oxopropyl]amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-(2-ethoxycarbonyloxyethylsulfonylmethyl)-3-naphthalen-1-ylpropanoyl]amino]hexanoate Traditional Name: 2-[[2-(2-carbethoxyoxyethylsulfonylmethyl)-3-(1-naphthyl)propanoyl]amino]hexanoic acid tert-butyl ester Formula: C29H41NO8S MolecularWeight: 563.70274

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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)CCOC(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C29H41NO8S/c1-6-8-16-25(27(32)38-29(3,4)5)30-26(31)23(20-39(34,35)18-17-37-28(33)36-7-2)19-22-14-11-13-21-12-9-10-15-24(21)22/h9-15,23,25H,6-8,16-20H2,1-5H3,(H,30,31)