[2,2-dimethyl-4-(1-methyl-2-oxidanylidene-pyridin-3-yl)-3-oxidanyl-3,4-dihydrochromen-6-yl] hydrogen carbonate

Systemtic Name: [2,2-dimethyl-4-(1-methyl-2-oxidanylidene-pyridin-3-yl)-3-oxidanyl-3,4-dihydrochromen-6-yl] hydrogen carbonate Openeye Name: [3-hydroxy-2,2-dimethyl-4-(1-methyl-2-oxo-3-pyridyl)chroman-6-yl] hydrogen carbonate CAS Name: carbonic acid [3-hydroxy-2,2-dimethyl-4-(1-methyl-2-oxo-3-pyridinyl)-3,4-dihydro-2H-1-benzopyran-6-yl] ester IUPAC Name: [3-hydroxy-2,2-dimethyl-4-(1-methyl-2-oxopyridin-3-yl)-3,4-dihydrochromen-6-yl] hydrogen carbonate Traditional Name: carbonic acid [3-hydroxy-4-(2-keto-1-methyl-3-pyridyl)-2,2-dimethyl-chroman-6-yl] ester Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)OC(=O)O)C3=CC=CN(C3=O)C)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)OC(=O)O)C3=CC=CN(C3=O)C)O)C

InChI

InChI=1S/C18H19NO6/c1-18(2)15(20)14(11-5-4-8-19(3)16(11)21)12-9-10(24-17(22)23)6-7-13(12)25-18/h4-9,14-15,20H,1-3H3,(H,22,23)