ethyl (2S,3S)-2-(hydroxymethyl)-7-naphthalen-1-yl-3-oxidanyl-heptanoate

Systemtic Name: ethyl (2S,3S)-2-(hydroxymethyl)-7-naphthalen-1-yl-3-oxidanyl-heptanoate Openeye Name: ethyl (2S,3S)-3-hydroxy-2-(hydroxymethyl)-7-(1-naphthyl)heptanoate CAS Name: (2S,3S)-3-hydroxy-2-(hydroxymethyl)-7-(1-naphthalenyl)heptanoic acid ethyl ester IUPAC Name: ethyl (2S,3S)-3-hydroxy-2-(hydroxymethyl)-7-naphthalen-1-ylheptanoate Traditional Name: (2S,3S)-3-hydroxy-2-methylol-7-(1-naphthyl)enanthic acid ethyl ester Formula: C20H26O4 MolecularWeight: 330.41804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CO)C(CCCCC1=CC=CC2=CC=CC=C21)O

Isomeric SMILES

CCOC(=O)[C@@H](CO)[C@H](CCCCC1=CC=CC2=CC=CC=C21)O

InChI

InChI=1S/C20H26O4/c1-2-24-20(23)18(14-21)19(22)13-6-4-9-16-11-7-10-15-8-3-5-12-17(15)16/h3,5,7-8,10-12,18-19,21-22H,2,4,6,9,13-14H2,1H3/t18-,19-/m0/s1