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2-methyl-6-pyren-1-yl-hexan-3-one

2-methyl-6-pyren-1-yl-hexan-3-one

Systemtic Name:2-methyl-6-pyren-1-yl-hexan-3-one
Openeye Name:2-methyl-6-pyren-1-yl-hexan-3-one
CAS Name:2-methyl-6-(1-pyrenyl)-3-hexanone
IUPAC Name:2-methyl-6-pyren-1-ylhexan-3-one
Traditional Name:2-methyl-6-pyren-1-yl-hexan-3-one
Formula: C23H22O
MolecularWeight: 314.42018
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)CCCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1


Isomeric SMILES

CC(C)C(=O)CCCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1


InChI

InChI=1S/C23H22O/c1-15(2)21(24)8-4-5-16-9-10-19-12-11-17-6-3-7-18-13-14-20(16)23(19)22(17)18/h3,6-7,9-15H,4-5,8H2,1-2H3


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