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(6-oxidanylidene-1,2-diazepin-3-yl)methanesulfonic acid

(6-oxidanylidene-1,2-diazepin-3-yl)methanesulfonic acid

Systemtic Name:(6-oxidanylidene-1,2-diazepin-3-yl)methanesulfonic acid
Openeye Name:(6-oxodiazepin-3-yl)methanesulfonic acid
CAS Name:(6-oxo-3-diazepinyl)methanesulfonic acid
IUPAC Name:(6-oxodiazepin-3-yl)methanesulfonic acid
Traditional Name:(6-ketodiazepin-3-yl)methanesulfonic acid
Formula: C6H6N2O4S
MolecularWeight: 202.18784
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NN=CC1=O)CS(=O)(=O)O


Isomeric SMILES

C1=CC(=NN=CC1=O)CS(=O)(=O)O


InChI

InChI=1S/C6H6N2O4S/c9-6-2-1-5(8-7-3-6)4-13(10,11)12/h1-3H,4H2,(H,10,11,12)


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