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

Systemtic Name: [(E)-[3-(aminomethyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]amino] methanesulfonate Openeye Name: [(E)-[3-(aminomethyl)-4-oxo-cyclohexa-2,5-dien-1-ylidene]amino] methanesulfonate CAS Name: methanesulfonic acid [(E)-[3-(aminomethyl)-4-oxo-1-cyclohexa-2,5-dienylidene]amino] ester IUPAC Name: [(E)-[3-(aminomethyl)-4-oxocyclohexa-2,5-dien-1-ylidene]amino] methanesulfonate Traditional Name: methanesulfonic acid [(E)-[3-(aminomethyl)-4-keto-cyclohexa-2,5-dien-1-ylidene]amino] ester Formula: C8H10N2O4S MolecularWeight: 230.241

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)ON=C1C=CC(=O)C(=C1)CN

Isomeric SMILES

CS(=O)(=O)O/N=C/1\C=CC(=O)C(=C1)CN

InChI

InChI=1S/C8H10N2O4S/c1-15(12,13)14-10-7-2-3-8(11)6(4-7)5-9/h2-4H,5,9H2,1H3/b10-7+