[4-chloranyl-6-(4-methylsulfonylphenyl)sulfonylimino-cyclohexa-2,4-dien-1-ylidene]-piperidin-1-yl-methanolate

Systemtic Name: [4-chloranyl-6-(4-methylsulfonylphenyl)sulfonylimino-cyclohexa-2,4-dien-1-ylidene]-piperidin-1-yl-methanolate Openeye Name: [4-chloro-6-(4-methylsulfonylphenyl)sulfonylimino-cyclohexa-2,4-dien-1-ylidene]-(1-piperidyl)methanolate CAS Name: [4-chloro-6-(4-methylsulfonylphenyl)sulfonylimino-1-cyclohexa-2,4-dienylidene]-(1-piperidinyl)methanolate IUPAC Name: [4-chloro-6-(4-methylsulfonylphenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-piperidin-1-ylmethanolate Traditional Name: [4-chloro-6-(4-mesylphenyl)sulfonylimino-cyclohexa-2,4-dien-1-ylidene]-piperidino-methanolate Formula: C19H20ClN2O5S2- MolecularWeight: 455.9555

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N=C2C=C(C=CC2=C(N3CCCCC3)[O-])Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N=C2C=C(C=CC2=C(N3CCCCC3)[O-])Cl

InChI

InChI=1S/C19H21ClN2O5S2/c1-28(24,25)15-6-8-16(9-7-15)29(26,27)21-18-13-14(20)5-10-17(18)19(23)22-11-3-2-4-12-22/h5-10,13,23H,2-4,11-12H2,1H3/p-1