[(E)-[2-(cyanomethyl)-5-methoxy-cyclohexa-2,4-dien-1-ylidene]amino] methanesulfonate

Systemtic Name: [(E)-[2-(cyanomethyl)-5-methoxy-cyclohexa-2,4-dien-1-ylidene]amino] methanesulfonate Openeye Name: [(E)-[2-(cyanomethyl)-5-methoxy-cyclohexa-2,4-dien-1-ylidene]amino] methanesulfonate CAS Name: methanesulfonic acid [(E)-[2-(cyanomethyl)-5-methoxy-1-cyclohexa-2,4-dienylidene]amino] ester IUPAC Name: [(E)-[2-(cyanomethyl)-5-methoxycyclohexa-2,4-dien-1-ylidene]amino] methanesulfonate Traditional Name: methanesulfonic acid [(E)-[2-(cyanomethyl)-5-methoxy-cyclohexa-2,4-dien-1-ylidene]amino] ester Formula: C10H12N2O4S MolecularWeight: 256.27828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C(=NOS(=O)(=O)C)C1)CC#N

Isomeric SMILES

COC1=CC=C(/C(=N/OS(=O)(=O)C)/C1)CC#N

InChI

InChI=1S/C10H12N2O4S/c1-15-9-4-3-8(5-6-11)10(7-9)12-16-17(2,13)14/h3-4H,5,7H2,1-2H3/b12-10+