4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-methyl-pyrimidine-5-carboxylate

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-methyl-pyrimidine-5-carboxylate Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-methyl-pyrimidine-5-carboxylate CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-methyl-5-pyrimidinecarboxylate IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-methylpyrimidine-5-carboxylate Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-methyl-pyrimidine-5-carboxylate Formula: C14H12N3O4- MolecularWeight: 286.26278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)NC2=CC3=C(C=C2)OCCO3)C(=O)[O-]

Isomeric SMILES

CC1=NC=C(C(=N1)NC2=CC3=C(C=C2)OCCO3)C(=O)[O-]

InChI

InChI=1S/C14H13N3O4/c1-8-15-7-10(14(18)19)13(16-8)17-9-2-3-11-12(6-9)21-5-4-20-11/h2-3,6-7H,4-5H2,1H3,(H,18,19)(H,15,16,17)/p-1