2-azanyl-2-[2-[3-(4-butoxy-2-methyl-phenyl)phenyl]ethyl]propane-1,3-diol

Systemtic Name: 2-azanyl-2-[2-[3-(4-butoxy-2-methyl-phenyl)phenyl]ethyl]propane-1,3-diol Openeye Name: 2-amino-2-[2-[3-(4-butoxy-2-methyl-phenyl)phenyl]ethyl]propane-1,3-diol CAS Name: 2-amino-2-[2-[3-(4-butoxy-2-methylphenyl)phenyl]ethyl]propane-1,3-diol IUPAC Name: 2-amino-2-[2-[3-(4-butoxy-2-methylphenyl)phenyl]ethyl]propane-1,3-diol Traditional Name: 2-amino-2-[2-[3-(4-butoxy-2-methyl-phenyl)phenyl]ethyl]propane-1,3-diol Formula: C22H31NO3 MolecularWeight: 357.48644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1)C2=CC(=CC=C2)CCC(CO)(CO)N)C

Isomeric SMILES

CCCCOC1=CC(=C(C=C1)C2=CC(=CC=C2)CCC(CO)(CO)N)C

InChI

InChI=1S/C22H31NO3/c1-3-4-12-26-20-8-9-21(17(2)13-20)19-7-5-6-18(14-19)10-11-22(23,15-24)16-25/h5-9,13-14,24-25H,3-4,10-12,15-16,23H2,1-2H3