N-[(3S,4R)-1-(oxan-2-yloxy)-4-oxidanyl-undecan-3-yl]-N-(phenylmethyl)hexanamide

Systemtic Name: N-[(3S,4R)-1-(oxan-2-yloxy)-4-oxidanyl-undecan-3-yl]-N-(phenylmethyl)hexanamide Openeye Name: N-benzyl-N-[(1S,2R)-2-hydroxy-1-(2-tetrahydropyran-2-yloxyethyl)nonyl]hexanamide CAS Name: N-[(3S,4R)-4-hydroxy-1-(2-oxanyloxy)undecan-3-yl]-N-(phenylmethyl)hexanamide IUPAC Name: N-benzyl-N-[(3S,4R)-4-hydroxy-1-(oxan-2-yloxy)undecan-3-yl]hexanamide Traditional Name: N-benzyl-N-[(1S,2R)-2-hydroxy-1-(2-tetrahydropyran-2-yloxyethyl)nonyl]hexanamide Formula: C29H49NO4 MolecularWeight: 475.70366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(CCOC1CCCCO1)N(CC2=CC=CC=C2)C(=O)CCCCC)O

Isomeric SMILES

CCCCCCC[C@H]([C@H](CCOC1CCCCO1)N(CC2=CC=CC=C2)C(=O)CCCCC)O

InChI

InChI=1S/C29H49NO4/c1-3-5-7-8-13-18-27(31)26(21-23-34-29-20-14-15-22-33-29)30(28(32)19-10-6-4-2)24-25-16-11-9-12-17-25/h9,11-12,16-17,26-27,29,31H,3-8,10,13-15,18-24H2,1-2H3/t26-,27+,29?/m0/s1