2-methyl-2-(3-pyren-1-ylpropylamino)propane-1,3-diol

Systemtic Name: 2-methyl-2-(3-pyren-1-ylpropylamino)propane-1,3-diol Openeye Name: 2-methyl-2-(3-pyren-1-ylpropylamino)propane-1,3-diol CAS Name: 2-methyl-2-[3-(1-pyrenyl)propylamino]propane-1,3-diol IUPAC Name: 2-methyl-2-(3-pyren-1-ylpropylamino)propane-1,3-diol Traditional Name: 2-methyl-2-(3-pyren-1-ylpropylamino)propane-1,3-diol Formula: C23H25NO2 MolecularWeight: 347.4501

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NCCCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Isomeric SMILES

CC(CO)(CO)NCCCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C23H25NO2/c1-23(14-25,15-26)24-13-3-6-16-7-8-19-10-9-17-4-2-5-18-11-12-20(16)22(19)21(17)18/h2,4-5,7-12,24-26H,3,6,13-15H2,1H3