tert-butyl N-[(3S,4S)-3-(hydroxymethyl)-4-oxidanyl-7-phenylmethoxy-heptyl]carbamate

Systemtic Name: tert-butyl N-[(3S,4S)-3-(hydroxymethyl)-4-oxidanyl-7-phenylmethoxy-heptyl]carbamate Openeye Name: tert-butyl N-[(3S,4S)-7-benzyloxy-4-hydroxy-3-(hydroxymethyl)heptyl]carbamate CAS Name: N-[(3S,4S)-4-hydroxy-3-(hydroxymethyl)-7-phenylmethoxyheptyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3S,4S)-4-hydroxy-3-(hydroxymethyl)-7-phenylmethoxyheptyl]carbamate Traditional Name: N-[(3S,4S)-7-benzoxy-4-hydroxy-3-methylol-heptyl]carbamic acid tert-butyl ester Formula: C20H33NO5 MolecularWeight: 367.47972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(CO)C(CCCOCC1=CC=CC=C1)O

Isomeric SMILES

CC(C)(C)OC(=O)NCC[C@@H](CO)[C@H](CCCOCC1=CC=CC=C1)O

InChI

InChI=1S/C20H33NO5/c1-20(2,3)26-19(24)21-12-11-17(14-22)18(23)10-7-13-25-15-16-8-5-4-6-9-16/h4-6,8-9,17-18,22-23H,7,10-15H2,1-3H3,(H,21,24)/t17-,18-/m0/s1