1-[4-[4-azanyl-4-(hydroxymethyl)-5-oxidanyl-pentyl]phenyl]decan-1-one hydrochloride

Systemtic Name: 1-[4-[4-azanyl-4-(hydroxymethyl)-5-oxidanyl-pentyl]phenyl]decan-1-one hydrochloride Openeye Name: 1-[4-[4-amino-5-hydroxy-4-(hydroxymethyl)pentyl]phenyl]decan-1-one hydrochloride CAS Name: 1-[4-[4-amino-5-hydroxy-4-(hydroxymethyl)pentyl]phenyl]-1-decanone hydrochloride IUPAC Name: 1-[4-[4-amino-5-hydroxy-4-(hydroxymethyl)pentyl]phenyl]decan-1-one hydrochloride Traditional Name: 1-[4-(4-amino-5-hydroxy-4-methylol-pentyl)phenyl]decan-1-one hydrochloride Formula: C22H38ClNO3 MolecularWeight: 399.99502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)C1=CC=C(C=C1)CCCC(CO)(CO)N.Cl

Isomeric SMILES

CCCCCCCCCC(=O)C1=CC=C(C=C1)CCCC(CO)(CO)N.Cl

InChI

InChI=1S/C22H37NO3.ClH/c1-2-3-4-5-6-7-8-11-21(26)20-14-12-19(13-15-20)10-9-16-22(23,17-24)18-25;/h12-15,24-25H,2-11,16-18,23H2,1H3;1H