(2-chloranyl-4-methylsulfonylimino-cyclohexa-2,5-dien-1-ylidene)-pyrrolidin-1-yl-methanolate

Systemtic Name: (2-chloranyl-4-methylsulfonylimino-cyclohexa-2,5-dien-1-ylidene)-pyrrolidin-1-yl-methanolate Openeye Name: (2-chloro-4-methylsulfonylimino-cyclohexa-2,5-dien-1-ylidene)-pyrrolidin-1-yl-methanolate CAS Name: (2-chloro-4-methylsulfonylimino-1-cyclohexa-2,5-dienylidene)-(1-pyrrolidinyl)methanolate IUPAC Name: (2-chloro-4-methylsulfonyliminocyclohexa-2,5-dien-1-ylidene)-pyrrolidin-1-ylmethanolate Traditional Name: (2-chloro-4-mesylimino-cyclohexa-2,5-dien-1-ylidene)-pyrrolidino-methanolate Formula: C12H14ClN2O3S- MolecularWeight: 301.76916

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N=C1C=CC(=C(N2CCCC2)[O-])C(=C1)Cl

Isomeric SMILES

CS(=O)(=O)N=C1C=CC(=C(N2CCCC2)[O-])C(=C1)Cl

InChI

InChI=1S/C12H15ClN2O3S/c1-19(17,18)14-9-4-5-10(11(13)8-9)12(16)15-6-2-3-7-15/h4-5,8,16H,2-3,6-7H2,1H3/p-1