ethanoyl-[4-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonyloxymethyl]-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene]azanium

Systemtic Name: ethanoyl-[4-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonyloxymethyl]-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene]azanium Openeye Name: acetyl-[2-hydroxy-4-[(5-methyl-3-phenyl-isoxazole-4-carbonyl)oxymethyl]-5,6,8,8a-tetrahydrochromen-7-ylidene]ammonium CAS Name: acetyl-[2-hydroxy-4-[[(5-methyl-3-phenyl-4-isoxazolyl)-oxomethoxy]methyl]-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene]ammonium IUPAC Name: acetyl-[2-hydroxy-4-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)oxymethyl]-5,6,8,8a-tetrahydrochromen-7-ylidene]azanium Traditional Name: acetyl-[2-hydroxy-4-[(5-methyl-3-phenyl-isoxazole-4-carbonyl)oxymethyl]-5,6,8,8a-tetrahydrochromen-7-ylidene]ammonium Formula: C23H23N2O6+ MolecularWeight: 423.43852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC3=C4CCC(=[NH+]C(=O)C)CC4OC(=C3)O

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC3=C4CCC(=[NH+]C(=O)C)CC4OC(=C3)O

InChI

InChI=1S/C23H22N2O6/c1-13-21(22(25-31-13)15-6-4-3-5-7-15)23(28)29-12-16-10-20(27)30-19-11-17(24-14(2)26)8-9-18(16)19/h3-7,10,19,27H,8-9,11-12H2,1-2H3/p+1