13-pyridin-3-ylpentacosan-13-ol hydrochloride

Systemtic Name: 13-pyridin-3-ylpentacosan-13-ol hydrochloride Openeye Name: 13-(3-pyridyl)pentacosan-13-ol hydrochloride CAS Name: 13-(3-pyridinyl)-13-pentacosanol hydrochloride IUPAC Name: 13-pyridin-3-ylpentacosan-13-ol hydrochloride Traditional Name: 13-(3-pyridyl)pentacosan-13-ol hydrochloride Formula: C30H56ClNO MolecularWeight: 482.22474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCCCCC)(C1=CN=CC=C1)O.Cl

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCCCCC)(C1=CN=CC=C1)O.Cl

InChI

InChI=1S/C30H55NO.ClH/c1-3-5-7-9-11-13-15-17-19-21-25-30(32,29-24-23-27-31-28-29)26-22-20-18-16-14-12-10-8-6-4-2;/h23-24,27-28,32H,3-22,25-26H2,1-2H3;1H