[(Z)-[cyano(cyclohexen-1-yl)methylidene]amino] butane-1-sulfonate

Systemtic Name: [(Z)-[cyano(cyclohexen-1-yl)methylidene]amino] butane-1-sulfonate Openeye Name: [(Z)-[cyano(cyclohexen-1-yl)methylene]amino] butane-1-sulfonate CAS Name: 1-butanesulfonic acid IUPAC Name: [(Z)-[cyano(cyclohexen-1-yl)methylidene]amino] butane-1-sulfonate Traditional Name: butane-1-sulfonic acid [(Z)-[cyano(cyclohexen-1-yl)methylene]amino] ester Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)ON=C(C#N)C1=CCCCC1

Isomeric SMILES

CCCCS(=O)(=O)O/N=C(\C#N)/C1=CCCCC1

InChI

InChI=1S/C12H18N2O3S/c1-2-3-9-18(15,16)17-14-12(10-13)11-7-5-4-6-8-11/h7H,2-6,8-9H2,1H3/b14-12+