[4-chloranyl-6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylimino)cyclohexa-2,4-dien-1-ylidene]-piperidin-1-yl-methanolate

Systemtic Name: [4-chloranyl-6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylimino)cyclohexa-2,4-dien-1-ylidene]-piperidin-1-yl-methanolate Openeye Name: [4-chloro-6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylimino)cyclohexa-2,4-dien-1-ylidene]-(1-piperidyl)methanolate CAS Name: [4-chloro-6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylimino)-1-cyclohexa-2,4-dienylidene]-(1-piperidinyl)methanolate IUPAC Name: [4-chloro-6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylimino)cyclohexa-2,4-dien-1-ylidene]-piperidin-1-ylmethanolate Traditional Name: [4-chloro-6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylimino)cyclohexa-2,4-dien-1-ylidene]-piperidino-methanolate Formula: C20H20ClN2O5S- MolecularWeight: 435.9012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=C2C=CC(=CC2=NS(=O)(=O)C3=CC4=C(C=C3)OCCO4)Cl)[O-]

Isomeric SMILES

C1CCN(CC1)C(=C2C=CC(=CC2=NS(=O)(=O)C3=CC4=C(C=C3)OCCO4)Cl)[O-]

InChI

InChI=1S/C20H21ClN2O5S/c21-14-4-6-16(20(24)23-8-2-1-3-9-23)17(12-14)22-29(25,26)15-5-7-18-19(13-15)28-11-10-27-18/h4-7,12-13,24H,1-3,8-11H2/p-1