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

Systemtic Name: [(E)-[5-chloranyl-2-(cyanomethyl)cyclohexa-2,4-dien-1-ylidene]amino] benzenesulfonate Openeye Name: [(E)-[5-chloro-2-(cyanomethyl)cyclohexa-2,4-dien-1-ylidene]amino] benzenesulfonate CAS Name: benzenesulfonic acid [(E)-[5-chloro-2-(cyanomethyl)-1-cyclohexa-2,4-dienylidene]amino] ester IUPAC Name: [(E)-[5-chloro-2-(cyanomethyl)cyclohexa-2,4-dien-1-ylidene]amino] benzenesulfonate Traditional Name: benzenesulfonic acid [(E)-[5-chloro-2-(cyanomethyl)cyclohexa-2,4-dien-1-ylidene]amino] ester Formula: C14H11ClN2O3S MolecularWeight: 322.76674

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC=C(C1=NOS(=O)(=O)C2=CC=CC=C2)CC#N)Cl

Isomeric SMILES

C\1C(=CC=C(/C1=N/OS(=O)(=O)C2=CC=CC=C2)CC#N)Cl

InChI

InChI=1S/C14H11ClN2O3S/c15-12-7-6-11(8-9-16)14(10-12)17-20-21(18,19)13-4-2-1-3-5-13/h1-7H,8,10H2/b17-14+