[(E)-[cyano-(4-methoxyphenyl)methylidene]amino] 2-dodecylbenzenesulfonate

Systemtic Name: [(E)-[cyano-(4-methoxyphenyl)methylidene]amino] 2-dodecylbenzenesulfonate Openeye Name: [(E)-[cyano-(4-methoxyphenyl)methylene]amino] 2-dodecylbenzenesulfonate CAS Name: 2-dodecylbenzenesulfonic acid [(E)-[cyano-(4-methoxyphenyl)methylidene]amino] ester IUPAC Name: [(E)-[cyano-(4-methoxyphenyl)methylidene]amino] 2-dodecylbenzenesulfonate Traditional Name: 2-laurylbenzenesulfonic acid [(E)-[cyano-(4-methoxyphenyl)methylene]amino] ester Formula: C27H36N2O4S MolecularWeight: 484.65074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)ON=C(C#N)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O/N=C(/C#N)\C2=CC=C(C=C2)OC

InChI

InChI=1S/C27H36N2O4S/c1-3-4-5-6-7-8-9-10-11-12-15-24-16-13-14-17-27(24)34(30,31)33-29-26(22-28)23-18-20-25(32-2)21-19-23/h13-14,16-21H,3-12,15H2,1-2H3/b29-26-