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

Systemtic Name: 1-[4-[4-azanyl-4-(hydroxymethyl)-5-oxidanyl-pentyl]phenyl]heptan-1-one Openeye Name: 1-[4-[4-amino-5-hydroxy-4-(hydroxymethyl)pentyl]phenyl]heptan-1-one CAS Name: 1-[4-[4-amino-5-hydroxy-4-(hydroxymethyl)pentyl]phenyl]-1-heptanone IUPAC Name: 1-[4-[4-amino-5-hydroxy-4-(hydroxymethyl)pentyl]phenyl]heptan-1-one Traditional Name: 1-[4-(4-amino-5-hydroxy-4-methylol-pentyl)phenyl]heptan-1-one Formula: C19H31NO3 MolecularWeight: 321.45434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C1=CC=C(C=C1)CCCC(CO)(CO)N

Isomeric SMILES

CCCCCCC(=O)C1=CC=C(C=C1)CCCC(CO)(CO)N

InChI

InChI=1S/C19H31NO3/c1-2-3-4-5-8-18(23)17-11-9-16(10-12-17)7-6-13-19(20,14-21)15-22/h9-12,21-22H,2-8,13-15,20H2,1H3