1-phenyl-2-(pyren-1-ylmethylamino)ethanol

Systemtic Name: 1-phenyl-2-(pyren-1-ylmethylamino)ethanol Openeye Name: 1-phenyl-2-(pyren-1-ylmethylamino)ethanol CAS Name: 1-phenyl-2-(1-pyrenylmethylamino)ethanol IUPAC Name: 1-phenyl-2-(pyren-1-ylmethylamino)ethanol Traditional Name: 1-phenyl-2-(pyren-1-ylmethylamino)ethanol Formula: C25H21NO MolecularWeight: 351.44034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2)O

Isomeric SMILES

C1=CC=C(C=C1)C(CNCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2)O

InChI

InChI=1S/C25H21NO/c27-23(17-5-2-1-3-6-17)16-26-15-21-12-11-20-10-9-18-7-4-8-19-13-14-22(21)25(20)24(18)19/h1-14,23,26-27H,15-16H2