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

Systemtic Name: [[4-[cyano-(2,4-dichlorophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] propane-2-sulfonate Openeye Name: [[4-[cyano-(2,4-dichlorophenyl)methylene]cyclohexa-2,5-dien-1-ylidene]amino] propane-2-sulfonate CAS Name: 2-propanesulfonic acid IUPAC Name: [[4-[cyano-(2,4-dichlorophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] propane-2-sulfonate Traditional Name: propane-2-sulfonic acid [[4-[cyano-(2,4-dichlorophenyl)methylene]cyclohexa-2,5-dien-1-ylidene]amino] ester Formula: C17H14Cl2N2O3S MolecularWeight: 397.27566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14Cl2N2O3S/c1-11(2)25(22,23)24-21-14-6-3-12(4-7-14)16(10-20)15-8-5-13(18)9-17(15)19/h3-9,11H,1-2H3