2-(chrysen-6-ylmethylamino)-2-(ethoxymethyl)propane-1,3-diol hydrochloride

Systemtic Name: 2-(chrysen-6-ylmethylamino)-2-(ethoxymethyl)propane-1,3-diol hydrochloride Openeye Name: 2-(chrysen-6-ylmethylamino)-2-(ethoxymethyl)propane-1,3-diol hydrochloride CAS Name: 2-(6-chrysenylmethylamino)-2-(ethoxymethyl)propane-1,3-diol hydrochloride IUPAC Name: 2-(chrysen-6-ylmethylamino)-2-(ethoxymethyl)propane-1,3-diol hydrochloride Traditional Name: 2-(chrysen-6-ylmethylamino)-2-(ethoxymethyl)propane-1,3-diol hydrochloride Formula: C25H28ClNO3 MolecularWeight: 425.94772

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(CO)(CO)NCC1=CC2=C(C=CC3=CC=CC=C32)C4=CC=CC=C41.Cl

Isomeric SMILES

CCOCC(CO)(CO)NCC1=CC2=C(C=CC3=CC=CC=C32)C4=CC=CC=C41.Cl

InChI

InChI=1S/C25H27NO3.ClH/c1-2-29-17-25(15-27,16-28)26-14-19-13-24-20-8-4-3-7-18(20)11-12-23(24)22-10-6-5-9-21(19)22;/h3-13,26-28H,2,14-17H2,1H3;1H