ethanoyl-[4-[3-(4-ethanoyl-5-methyl-furan-2-yl)propanoyloxymethyl]-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene]azanium

Systemtic Name: ethanoyl-[4-[3-(4-ethanoyl-5-methyl-furan-2-yl)propanoyloxymethyl]-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene]azanium Openeye Name: acetyl-[4-[3-(4-acetyl-5-methyl-2-furyl)propanoyloxymethyl]-2-hydroxy-5,6,8,8a-tetrahydrochromen-7-ylidene]ammonium CAS Name: acetyl-[4-[[3-(4-acetyl-5-methyl-2-furanyl)-1-oxopropoxy]methyl]-2-hydroxy-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene]ammonium IUPAC Name: acetyl-[4-[3-(4-acetyl-5-methylfuran-2-yl)propanoyloxymethyl]-2-hydroxy-5,6,8,8a-tetrahydrochromen-7-ylidene]azanium Traditional Name: acetyl-[4-[3-(4-acetyl-5-methyl-2-furyl)propanoyloxymethyl]-2-hydroxy-5,6,8,8a-tetrahydrochromen-7-ylidene]ammonium Formula: C22H26NO7+ MolecularWeight: 416.44434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CCC(=O)OCC2=C3CCC(=[NH+]C(=O)C)CC3OC(=C2)O)C(=O)C

Isomeric SMILES

CC1=C(C=C(O1)CCC(=O)OCC2=C3CCC(=[NH+]C(=O)C)CC3OC(=C2)O)C(=O)C

InChI

InChI=1S/C22H25NO7/c1-12(24)19-10-17(29-13(19)2)5-7-21(26)28-11-15-8-22(27)30-20-9-16(23-14(3)25)4-6-18(15)20/h8,10,20,27H,4-7,9,11H2,1-3H3/p+1