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2-(2-ethylhexyl)anthracene-1-carboxylate

2-(2-ethylhexyl)anthracene-1-carboxylate

Systemtic Name:2-(2-ethylhexyl)anthracene-1-carboxylate
Openeye Name:2-(2-ethylhexyl)anthracene-1-carboxylate
CAS Name:2-(2-ethylhexyl)-1-anthracenecarboxylate
IUPAC Name:2-(2-ethylhexyl)anthracene-1-carboxylate
Traditional Name:2-(2-ethylhexyl)anthracene-1-carboxylate
Formula: C23H25O2-
MolecularWeight: 333.4434
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC1=C(C2=CC3=CC=CC=C3C=C2C=C1)C(=O)[O-]


Isomeric SMILES

CCCCC(CC)CC1=C(C2=CC3=CC=CC=C3C=C2C=C1)C(=O)[O-]


InChI

InChI=1S/C23H26O2/c1-3-5-8-16(4-2)13-20-12-11-19-14-17-9-6-7-10-18(17)15-21(19)22(20)23(24)25/h6-7,9-12,14-16H,3-5,8,13H2,1-2H3,(H,24,25)/p-1


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