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

Systemtic Name: [(E)-(3-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] methanesulfonate Openeye Name: [(E)-(3-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] methanesulfonate CAS Name: methanesulfonic acid [(E)-(3-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(E)-(3-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] methanesulfonate Traditional Name: methanesulfonic acid [(E)-(4-keto-3-methyl-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C8H9NO4S MolecularWeight: 215.22636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C/C(=N/OS(=O)(=O)C)/C=CC1=O

InChI

InChI=1S/C8H9NO4S/c1-6-5-7(3-4-8(6)10)9-13-14(2,11)12/h3-5H,1-2H3/b9-7+