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3-methyl-2-(pyren-1-ylmethylamino)butan-1-ol chloride

3-methyl-2-(pyren-1-ylmethylamino)butan-1-ol chloride

Systemtic Name:3-methyl-2-(pyren-1-ylmethylamino)butan-1-ol chloride
Openeye Name:3-methyl-2-(pyren-1-ylmethylamino)butan-1-ol chloride
CAS Name:3-methyl-2-(1-pyrenylmethylamino)-1-butanol chloride
IUPAC Name:3-methyl-2-(pyren-1-ylmethylamino)butan-1-ol chloride
Traditional Name:3-methyl-2-(pyren-1-ylmethylamino)butan-1-ol chloride
Formula: C22H23ClNO-
MolecularWeight: 352.87712
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C22H23NO.ClH/c1-14(2)20(13-24)23-12-18-9-8-17-7-6-15-4-3-5-16-10-11-19(18)22(17)21(15)16;/h3-11,14,20,23-24H,12-13H2,1-2H3;1H/p-1


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