2-(ethoxymethyl)-2-(perylen-3-ylmethylamino)propane-1,3-diol

Systemtic Name: 2-(ethoxymethyl)-2-(perylen-3-ylmethylamino)propane-1,3-diol Openeye Name: 2-(ethoxymethyl)-2-(perylen-3-ylmethylamino)propane-1,3-diol CAS Name: 2-(ethoxymethyl)-2-(3-perylenylmethylamino)propane-1,3-diol IUPAC Name: 2-(ethoxymethyl)-2-(perylen-3-ylmethylamino)propane-1,3-diol Traditional Name: 2-(ethoxymethyl)-2-(perylen-3-ylmethylamino)propane-1,3-diol Formula: C27H27NO3 MolecularWeight: 413.50818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC(CO)(CO)NCC1=CC=C2C3=CC=CC4=C3C(=CC=C4)C5=C2C1=CC=C5

Isomeric SMILES

CCOCC(CO)(CO)NCC1=CC=C2C3=CC=CC4=C3C(=CC=C4)C5=C2C1=CC=C5

InChI

InChI=1S/C27H27NO3/c1-2-31-17-27(15-29,16-30)28-14-19-12-13-24-22-10-4-7-18-6-3-9-21(25(18)22)23-11-5-8-20(19)26(23)24/h3-13,28-30H,2,14-17H2,1H3