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2-(pyren-1-ylmethylamino)propan-1-ol hydrochloride

2-(pyren-1-ylmethylamino)propan-1-ol hydrochloride

Systemtic Name:2-(pyren-1-ylmethylamino)propan-1-ol hydrochloride
Openeye Name:2-(pyren-1-ylmethylamino)propan-1-ol hydrochloride
CAS Name:2-(1-pyrenylmethylamino)-1-propanol hydrochloride
IUPAC Name:2-(pyren-1-ylmethylamino)propan-1-ol hydrochloride
Traditional Name:2-(pyren-1-ylmethylamino)propan-1-ol hydrochloride
Formula: C20H20ClNO
MolecularWeight: 325.8319
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C20H19NO.ClH/c1-13(12-22)21-11-17-8-7-16-6-5-14-3-2-4-15-9-10-18(17)20(16)19(14)15;/h2-10,13,21-22H,11-12H2,1H3;1H


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