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3aH-cyclopenta[a]chrysene; undecanoic acid

3aH-cyclopenta[a]chrysene; undecanoic acid

Systemtic Name:3aH-cyclopenta[a]chrysene; undecanoic acid
Openeye Name:3aH-cyclopenta[a]chrysene; undecanoic acid
CAS Name:3aH-cyclopenta[a]chrysene; undecanoic acid
IUPAC Name:3aH-cyclopenta[a]chrysene; undecanoic acid
Traditional Name:3aH-cyclopenta[a]chrysene; undecanoic acid
Formula: C32H36O2
MolecularWeight: 452.62704
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)O.C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC5C4=CC=C5


Isomeric SMILES

CCCCCCCCCCC(=O)O.C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC5C4=CC=C5


InChI

InChI=1S/C21H14.C11H22O2/c1-2-6-16-14(4-1)8-10-20-18(16)12-13-19-17-7-3-5-15(17)9-11-21(19)20;1-2-3-4-5-6-7-8-9-10-11(12)13/h1-13,15H;2-10H2,1H3,(H,12,13)


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