tert-butyl N-[6-oxidanylidenehexoxy-(2-oxidanyl-4-phenyl-butyl)phosphoryl]carbamate

Systemtic Name: tert-butyl N-[6-oxidanylidenehexoxy-(2-oxidanyl-4-phenyl-butyl)phosphoryl]carbamate Openeye Name: tert-butyl N-[(2-hydroxy-4-phenyl-butyl)-(6-oxohexoxy)phosphoryl]carbamate CAS Name: N-[(2-hydroxy-4-phenylbutyl)-(6-oxohexoxy)phosphoryl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2-hydroxy-4-phenylbutyl)-(6-oxohexoxy)phosphoryl]carbamate Traditional Name: N-[(2-hydroxy-4-phenyl-butyl)-(6-ketohexoxy)phosphoryl]carbamic acid tert-butyl ester Formula: C21H34NO6P MolecularWeight: 427.471521

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NP(=O)(CC(CCC1=CC=CC=C1)O)OCCCCCC=O

Isomeric SMILES

CC(C)(C)OC(=O)NP(=O)(CC(CCC1=CC=CC=C1)O)OCCCCCC=O

InChI

InChI=1S/C21H34NO6P/c1-21(2,3)28-20(25)22-29(26,27-16-10-5-4-9-15-23)17-19(24)14-13-18-11-7-6-8-12-18/h6-8,11-12,15,19,24H,4-5,9-10,13-14,16-17H2,1-3H3,(H,22,25,26)