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cyclohexa-2,4-dien-1-yl(phenyl)methanone; methanesulfonic acid

cyclohexa-2,4-dien-1-yl(phenyl)methanone; methanesulfonic acid

Systemtic Name:cyclohexa-2,4-dien-1-yl(phenyl)methanone; methanesulfonic acid
Openeye Name:cyclohexa-2,4-dien-1-yl(phenyl)methanone; methanesulfonic acid
CAS Name:1-cyclohexa-2,4-dienyl(phenyl)methanone; methanesulfonic acid
IUPAC Name:cyclohexa-2,4-dien-1-yl(phenyl)methanone; methanesulfonic acid
Traditional Name:cyclohexa-2,4-dien-1-yl(phenyl)methanone; mesylic acid
Formula: C14H16O4S
MolecularWeight: 280.33944
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1C=CC=CC1C(=O)C2=CC=CC=C2


Isomeric SMILES

CS(=O)(=O)O.C1C=CC=CC1C(=O)C2=CC=CC=C2


InChI

InChI=1S/C13H12O.CH4O3S/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-5(2,3)4/h1-9,12H,10H2;1H3,(H,2,3,4)


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