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coronene; pyrene

coronene; pyrene

Systemtic Name:coronene; pyrene
Openeye Name:coronene; pyrene
CAS Name:coronene; pyrene
IUPAC Name:coronene; pyrene
Traditional Name:coronene; pyrene
Formula: C40H22
MolecularWeight: 502.60268
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2.C1=CC2=C3C4=C1C=CC5=C4C6=C(C=C5)C=CC7=C6C3=C(C=C2)C=C7


Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2.C1=CC2=C3C4=C1C=CC5=C4C6=C(C=C5)C=CC7=C6C3=C(C=C2)C=C7


InChI

InChI=1S/C24H12.C16H10/c1-2-14-5-6-16-9-11-18-12-10-17-8-7-15-4-3-13(1)19-20(14)22(16)24(18)23(17)21(15)19;1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-12H;1-10H


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