calcium; 2-chloranyl-1,4-di(propan-2-yl)benzene; sulfur dioxide

Systemtic Name: calcium; 2-chloranyl-1,4-di(propan-2-yl)benzene; sulfur dioxide Openeye Name: calcium; 2-chloro-1,4-diisopropyl-benzene; sulfur dioxide CAS Name: calcium; 2-chloro-1,4-di(propan-2-yl)benzene; sulfur dioxide IUPAC Name: calcium; 2-chloro-1,4-di(propan-2-yl)benzene; sulfur dioxide Traditional Name: calcium; 2-chloro-1,4-diisopropyl-benzene; sulfur dioxide Formula: C12H17CaClO2S+2 MolecularWeight: 300.85818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)C(C)C)Cl.O=S=O.[Ca+2]

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)C(C)C)Cl.O=S=O.[Ca+2]

InChI

InChI=1S/C12H17Cl.Ca.O2S/c1-8(2)10-5-6-11(9(3)4)12(13)7-10;;1-3-2/h5-9H,1-4H3;;/q;+2;