2-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 2-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 2-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 2-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 2-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C14H12N2O5 MolecularWeight: 288.25548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C2COC3=CC=CC=C3O2)C(=O)O

Isomeric SMILES

CC1=C(C(=O)N=C(N1)[C@H]2COC3=CC=CC=C3O2)C(=O)O

InChI

InChI=1S/C14H12N2O5/c1-7-11(14(18)19)13(17)16-12(15-7)10-6-20-8-4-2-3-5-9(8)21-10/h2-5,10H,6H2,1H3,(H,18,19)(H,15,16,17)/t10-/m1/s1