2-methyl-2-(pyren-4-ylmethylamino)propane-1,3-diol

Systemtic Name: 2-methyl-2-(pyren-4-ylmethylamino)propane-1,3-diol Openeye Name: 2-methyl-2-(pyren-4-ylmethylamino)propane-1,3-diol CAS Name: 2-methyl-2-(4-pyrenylmethylamino)propane-1,3-diol IUPAC Name: 2-methyl-2-(pyren-4-ylmethylamino)propane-1,3-diol Traditional Name: 2-methyl-2-(pyren-4-ylmethylamino)propane-1,3-diol Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NCC1=CC2=CC=CC3=C2C4=C(C=CC=C14)C=C3

Isomeric SMILES

CC(CO)(CO)NCC1=CC2=CC=CC3=C2C4=C(C=CC=C14)C=C3

InChI

InChI=1S/C21H21NO2/c1-21(12-23,13-24)22-11-17-10-16-6-2-4-14-8-9-15-5-3-7-18(17)20(15)19(14)16/h2-10,22-24H,11-13H2,1H3