4-[4-(1-oxidanylbutylidene)-3,5-bis(oxidanylidene)cyclohexyl]naphthalene-1-sulfonyl chloride

Systemtic Name: 4-[4-(1-oxidanylbutylidene)-3,5-bis(oxidanylidene)cyclohexyl]naphthalene-1-sulfonyl chloride Openeye Name: 4-[4-(1-hydroxybutylidene)-3,5-dioxo-cyclohexyl]naphthalene-1-sulfonyl chloride CAS Name: 4-[4-(1-hydroxybutylidene)-3,5-dioxocyclohexyl]-1-naphthalenesulfonyl chloride IUPAC Name: 4-[4-(1-hydroxybutylidene)-3,5-dioxocyclohexyl]naphthalene-1-sulfonyl chloride Traditional Name: 4-[4-(1-hydroxybutylidene)-3,5-diketo-cyclohexyl]naphthalene-1-sulfonyl chloride Formula: C20H19ClO5S MolecularWeight: 406.87986

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C(=O)CC(CC1=O)C2=CC=C(C3=CC=CC=C23)S(=O)(=O)Cl)O

Isomeric SMILES

CCCC(=C1C(=O)CC(CC1=O)C2=CC=C(C3=CC=CC=C23)S(=O)(=O)Cl)O

InChI

InChI=1S/C20H19ClO5S/c1-2-5-16(22)20-17(23)10-12(11-18(20)24)13-8-9-19(27(21,25)26)15-7-4-3-6-14(13)15/h3-4,6-9,12,22H,2,5,10-11H2,1H3