[3-(3,3-dimethyl-1-oxidanylidene-4H-isochromen-4-yl)imidazol-4-yl] hydrogen carbonate

Systemtic Name: [3-(3,3-dimethyl-1-oxidanylidene-4H-isochromen-4-yl)imidazol-4-yl] hydrogen carbonate Openeye Name: [3-(3,3-dimethyl-1-oxo-isochroman-4-yl)imidazol-4-yl] hydrogen carbonate CAS Name: carbonic acid [3-(3,3-dimethyl-1-oxo-3,4-dihydro-1H-2-benzopyran-4-yl)-4-imidazolyl] ester IUPAC Name: [3-(3,3-dimethyl-1-oxo-4H-isochromen-4-yl)imidazol-4-yl] hydrogen carbonate Traditional Name: carbonic acid [3-(1-keto-3,3-dimethyl-isochroman-4-yl)imidazol-4-yl] ester Formula: C15H14N2O5 MolecularWeight: 302.28206

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=CC=CC=C2C(=O)O1)N3C=NC=C3OC(=O)O)C

Isomeric SMILES

CC1(C(C2=CC=CC=C2C(=O)O1)N3C=NC=C3OC(=O)O)C

InChI

InChI=1S/C15H14N2O5/c1-15(2)12(17-8-16-7-11(17)21-14(19)20)9-5-3-4-6-10(9)13(18)22-15/h3-8,12H,1-2H3,(H,19,20)