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butanoate; pyrene

butanoate; pyrene

Systemtic Name:butanoate; pyrene
Openeye Name:butanoate; pyrene
CAS Name:butanoate; pyrene
IUPAC Name:butanoate; pyrene
Traditional Name:butyrate; pyrene
Formula: C20H17O2-
MolecularWeight: 289.34778
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)[O-].C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2


Isomeric SMILES

CCCC(=O)[O-].C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2


InChI

InChI=1S/C16H10.C4H8O2/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14;1-2-3-4(5)6/h1-10H;2-3H2,1H3,(H,5,6)/p-1


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