4-chloranyl-2-(3-fluorosulfonyl-4-hexadecoxy-phenyl)quinoline-6-sulfonyl fluoride

Systemtic Name: 4-chloranyl-2-(3-fluorosulfonyl-4-hexadecoxy-phenyl)quinoline-6-sulfonyl fluoride Openeye Name: 4-chloro-2-(3-fluorosulfonyl-4-hexadecoxy-phenyl)quinoline-6-sulfonyl fluoride CAS Name: 4-chloro-2-(3-fluorosulfonyl-4-hexadecoxyphenyl)-6-quinolinesulfonyl fluoride IUPAC Name: 4-chloro-2-(3-fluorosulfonyl-4-hexadecoxyphenyl)quinoline-6-sulfonyl fluoride Traditional Name: 2-(4-cetyloxy-3-fluorosulfonyl-phenyl)-4-chloro-quinoline-6-sulfonyl fluoride Formula: C31H40ClF2NO5S2 MolecularWeight: 644.232806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)S(=O)(=O)F)C(=C2)Cl)S(=O)(=O)F

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)S(=O)(=O)F)C(=C2)Cl)S(=O)(=O)F

InChI

InChI=1S/C31H40ClF2NO5S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-40-30-19-16-24(21-31(30)42(34,38)39)29-23-27(32)26-22-25(41(33,36)37)17-18-28(26)35-29/h16-19,21-23H,2-15,20H2,1H3