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

Systemtic Name: [(E)-[2-(cyanomethyl)-5-methoxy-cyclohexa-2,4-dien-1-ylidene]amino] ethanesulfonate Openeye Name: [(E)-[2-(cyanomethyl)-5-methoxy-cyclohexa-2,4-dien-1-ylidene]amino] ethanesulfonate CAS Name: ethanesulfonic 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] ethanesulfonate Traditional Name: ethanesulfonic acid [(E)-[2-(cyanomethyl)-5-methoxy-cyclohexa-2,4-dien-1-ylidene]amino] ester Formula: C11H14N2O4S MolecularWeight: 270.30486

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)ON=C1CC(=CC=C1CC#N)OC

Isomeric SMILES

CCS(=O)(=O)O/N=C/1\CC(=CC=C1CC#N)OC

InChI

InChI=1S/C11H14N2O4S/c1-3-18(14,15)17-13-11-8-10(16-2)5-4-9(11)6-7-12/h4-5H,3,6,8H2,1-2H3/b13-11+