calcium 4-oxidaniumylidenepentan-2-ylideneoxidanium

Systemtic Name: calcium 4-oxidaniumylidenepentan-2-ylideneoxidanium Openeye Name: calcium (1-methyl-3-oxoniumylidene-butylidene)oxonium CAS Name: calcium 4-oxoniumylidenepentan-2-ylideneoxonium IUPAC Name: calcium 4-oxoniumylidenepentan-2-ylideneoxidanium Traditional Name: calcium (1-methyl-3-oxoniumylidene-butylidene)oxonium Formula: C10H20CaO4+6 MolecularWeight: 244.3414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[OH+])CC(=[OH+])C.CC(=[OH+])CC(=[OH+])C.[Ca+2]

Isomeric SMILES

CC(=[OH+])CC(=[OH+])C.CC(=[OH+])CC(=[OH+])C.[Ca+2]

InChI

InChI=1S/2C5H8O2.Ca/c2*1-4(6)3-5(2)7;/h2*3H2,1-2H3;/q;;+2/p+4