2-(ethoxymethyl)-2-(pyren-1-ylmethylamino)propane-1,3-diol hydrochloride

Systemtic Name: 2-(ethoxymethyl)-2-(pyren-1-ylmethylamino)propane-1,3-diol hydrochloride Openeye Name: 2-(ethoxymethyl)-2-(pyren-1-ylmethylamino)propane-1,3-diol hydrochloride CAS Name: 2-(ethoxymethyl)-2-(1-pyrenylmethylamino)propane-1,3-diol hydrochloride IUPAC Name: 2-(ethoxymethyl)-2-(pyren-1-ylmethylamino)propane-1,3-diol hydrochloride Traditional Name: 2-(ethoxymethyl)-2-(pyren-1-ylmethylamino)propane-1,3-diol hydrochloride Formula: C23H26ClNO3 MolecularWeight: 399.91044

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(CO)(CO)NCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1.Cl

Isomeric SMILES

CCOCC(CO)(CO)NCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1.Cl

InChI

InChI=1S/C23H25NO3.ClH/c1-2-27-15-23(13-25,14-26)24-12-19-9-8-18-7-6-16-4-3-5-17-10-11-20(19)22(18)21(16)17;/h3-11,24-26H,2,12-15H2,1H3;1H