(phenylmethyl) N-[(2R,3R)-3-oxidanyl-6,17-bis(oxidanylidene)octadecan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2R,3R)-3-oxidanyl-6,17-bis(oxidanylidene)octadecan-2-yl]carbamate Openeye Name: benzyl N-[(1R,2R)-2-hydroxy-1-methyl-5,16-dioxo-heptadecyl]carbamate CAS Name: N-[(2R,3R)-3-hydroxy-6,17-dioxooctadecan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2R,3R)-3-hydroxy-6,17-dioxooctadecan-2-yl]carbamate Traditional Name: N-[(1R,2R)-2-hydroxy-5,16-diketo-1-methyl-heptadecyl]carbamic acid benzyl ester Formula: C26H41NO5 MolecularWeight: 447.60744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCC(=O)CCCCCCCCCCC(=O)C)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

C[C@H]([C@@H](CCC(=O)CCCCCCCCCCC(=O)C)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C26H41NO5/c1-21(28)14-10-7-5-3-4-6-8-13-17-24(29)18-19-25(30)22(2)27-26(31)32-20-23-15-11-9-12-16-23/h9,11-12,15-16,22,25,30H,3-8,10,13-14,17-20H2,1-2H3,(H,27,31)/t22-,25-/m1/s1