(phenylmethyl) (3R,4R)-3-(tert-butylamino)-2-oxidanylidene-4-undecyl-azetidine-1-carboxylate

Systemtic Name: (phenylmethyl) (3R,4R)-3-(tert-butylamino)-2-oxidanylidene-4-undecyl-azetidine-1-carboxylate Openeye Name: benzyl (3R,4R)-3-(tert-butylamino)-2-oxo-4-undecyl-azetidine-1-carboxylate CAS Name: (3R,4R)-3-(tert-butylamino)-2-oxo-4-undecyl-1-azetidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3R,4R)-3-(tert-butylamino)-2-oxo-4-undecylazetidine-1-carboxylate Traditional Name: (3R,4R)-3-(tert-butylamino)-2-keto-4-undecyl-azetidine-1-carboxylic acid benzyl ester Formula: C26H42N2O3 MolecularWeight: 430.62328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1C(C(=O)N1C(=O)OCC2=CC=CC=C2)NC(C)(C)C

Isomeric SMILES

CCCCCCCCCCC[C@@H]1[C@H](C(=O)N1C(=O)OCC2=CC=CC=C2)NC(C)(C)C

InChI

InChI=1S/C26H42N2O3/c1-5-6-7-8-9-10-11-12-16-19-22-23(27-26(2,3)4)24(29)28(22)25(30)31-20-21-17-14-13-15-18-21/h13-15,17-18,22-23,27H,5-12,16,19-20H2,1-4H3/t22-,23-/m1/s1