[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] methanesulfonate

Systemtic Name: [(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] methanesulfonate Openeye Name: [(3,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] methanesulfonate CAS Name: methanesulfonic acid [(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] methanesulfonate Traditional Name: methanesulfonic acid [(4-keto-3,5-dimethyl-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C9H11NO4S MolecularWeight: 229.25294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NOS(=O)(=O)C)C=C(C1=O)C

Isomeric SMILES

CC1=CC(=NOS(=O)(=O)C)C=C(C1=O)C

InChI

InChI=1S/C9H11NO4S/c1-6-4-8(5-7(2)9(6)11)10-14-15(3,12)13/h4-5H,1-3H3