[[4-[cyano-(2,4-dichlorophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] 4-dodecylbenzenesulfonate

Systemtic Name: [[4-[cyano-(2,4-dichlorophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] 4-dodecylbenzenesulfonate Openeye Name: [[4-[cyano-(2,4-dichlorophenyl)methylene]cyclohexa-2,5-dien-1-ylidene]amino] 4-dodecylbenzenesulfonate CAS Name: 4-dodecylbenzenesulfonic acid [[4-[cyano-(2,4-dichlorophenyl)methylidene]-1-cyclohexa-2,5-dienylidene]amino] ester IUPAC Name: [[4-[cyano-(2,4-dichlorophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] 4-dodecylbenzenesulfonate Traditional Name: 4-laurylbenzenesulfonic acid [[4-[cyano-(2,4-dichlorophenyl)methylene]cyclohexa-2,5-dien-1-ylidene]amino] ester Formula: C32H36Cl2N2O3S MolecularWeight: 599.61084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)ON=C2C=CC(=C(C#N)C3=C(C=C(C=C3)Cl)Cl)C=C2

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)ON=C2C=CC(=C(C#N)C3=C(C=C(C=C3)Cl)Cl)C=C2

InChI

InChI=1S/C32H36Cl2N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-25-13-20-29(21-14-25)40(37,38)39-36-28-18-15-26(16-19-28)31(24-35)30-22-17-27(33)23-32(30)34/h13-23H,2-12H2,1H3