3-azanyl-3-(hydroxymethyl)-1-(4-octylphenyl)-4-oxidanyl-butan-1-one

Systemtic Name: 3-azanyl-3-(hydroxymethyl)-1-(4-octylphenyl)-4-oxidanyl-butan-1-one Openeye Name: 3-amino-4-hydroxy-3-(hydroxymethyl)-1-(4-octylphenyl)butan-1-one CAS Name: 3-amino-4-hydroxy-3-(hydroxymethyl)-1-(4-octylphenyl)-1-butanone IUPAC Name: 3-amino-4-hydroxy-3-(hydroxymethyl)-1-(4-octylphenyl)butan-1-one Traditional Name: 3-amino-4-hydroxy-3-methylol-1-(4-octylphenyl)butan-1-one Formula: C19H31NO3 MolecularWeight: 321.45434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(=O)CC(CO)(CO)N

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(=O)CC(CO)(CO)N

InChI

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