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3-(pyren-1-ylmethylamino)propanenitrile chloride

3-(pyren-1-ylmethylamino)propanenitrile chloride

Systemtic Name:3-(pyren-1-ylmethylamino)propanenitrile chloride
Openeye Name:3-(pyren-1-ylmethylamino)propanenitrile chloride
CAS Name:3-(1-pyrenylmethylamino)propanenitrile chloride
IUPAC Name:3-(pyren-1-ylmethylamino)propanenitrile chloride
Traditional Name:3-(pyren-1-ylmethylamino)propionitrile chloride
Formula: C20H16ClN2-
MolecularWeight: 319.80744
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CNCCC#N.[Cl-]


Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CNCCC#N.[Cl-]


InChI

InChI=1S/C20H16N2.ClH/c21-11-2-12-22-13-17-8-7-16-6-5-14-3-1-4-15-9-10-18(17)20(16)19(14)15;/h1,3-10,22H,2,12-13H2;1H/p-1


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