[(Z)-[cyano-(3,4-dimethoxyphenyl)methylidene]amino] 4-chloranylbenzenesulfonate

Systemtic Name: [(Z)-[cyano-(3,4-dimethoxyphenyl)methylidene]amino] 4-chloranylbenzenesulfonate Openeye Name: [(Z)-[cyano-(3,4-dimethoxyphenyl)methylene]amino] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [(Z)-[cyano-(3,4-dimethoxyphenyl)methylidene]amino] ester IUPAC Name: [(Z)-[cyano-(3,4-dimethoxyphenyl)methylidene]amino] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [(Z)-[cyano-(3,4-dimethoxyphenyl)methylene]amino] ester Formula: C16H13ClN2O5S MolecularWeight: 380.80282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=NOS(=O)(=O)C2=CC=C(C=C2)Cl)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=N/OS(=O)(=O)C2=CC=C(C=C2)Cl)/C#N)OC

InChI

InChI=1S/C16H13ClN2O5S/c1-22-15-8-3-11(9-16(15)23-2)14(10-18)19-24-25(20,21)13-6-4-12(17)5-7-13/h3-9H,1-2H3/b19-14+