1,6-dimethyl-3-(2-oxidanylidene-3-prop-2-ynyl-1,3-benzoxazol-5-yl)pyrimidine-2,4-dione

Systemtic Name: 1,6-dimethyl-3-(2-oxidanylidene-3-prop-2-ynyl-1,3-benzoxazol-5-yl)pyrimidine-2,4-dione Openeye Name: 1,6-dimethyl-3-(2-oxo-3-prop-2-ynyl-1,3-benzoxazol-5-yl)pyrimidine-2,4-dione CAS Name: 1,6-dimethyl-3-(2-oxo-3-prop-2-ynyl-1,3-benzoxazol-5-yl)pyrimidine-2,4-dione IUPAC Name: 1,6-dimethyl-3-(2-oxo-3-prop-2-ynyl-1,3-benzoxazol-5-yl)pyrimidine-2,4-dione Traditional Name: 3-(2-keto-3-propargyl-1,3-benzoxazol-5-yl)-1,6-dimethyl-pyrimidine-2,4-quinone Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=O)N1C)C2=CC3=C(C=C2)OC(=O)N3CC#C

Isomeric SMILES

CC1=CC(=O)N(C(=O)N1C)C2=CC3=C(C=C2)OC(=O)N3CC#C

InChI

InChI=1S/C16H13N3O4/c1-4-7-18-12-9-11(5-6-13(12)23-16(18)22)19-14(20)8-10(2)17(3)15(19)21/h1,5-6,8-9H,7H2,2-3H3