7-(2-dimethylaminoethyloxy)-2-phenyl-chromen-4-one; 2-[1,3-dimethyl-2,6-bis(oxidanylidene)-4,5-dihydropurin-7-yl]ethanoic acid

Systemtic Name: 7-(2-dimethylaminoethyloxy)-2-phenyl-chromen-4-one; 2-[1,3-dimethyl-2,6-bis(oxidanylidene)-4,5-dihydropurin-7-yl]ethanoic acid Openeye Name: 7-(2-dimethylaminoethyloxy)-2-phenyl-chromen-4-one; 2-(1,3-dimethyl-2,6-dioxo-4,5-dihydropurin-7-yl)acetic acid CAS Name: 7-(2-dimethylaminoethyloxy)-2-phenyl-1-benzopyran-4-one; 2-(1,3-dimethyl-2,6-dioxo-4,5-dihydropurin-7-yl)acetic acid IUPAC Name: 7-(2-dimethylaminoethyloxy)-2-phenylchromen-4-one; 2-(1,3-dimethyl-2,6-dioxo-4,5-dihydropurin-7-yl)acetic acid Traditional Name: 2-(2,6-diketo-1,3-dimethyl-4,5-dihydropurin-7-yl)acetic acid; 7-(2-dimethylaminoethyloxy)-2-phenyl-chromone Formula: C28H31N5O7 MolecularWeight: 549.57504

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O.CN(C)CCOC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC=CC=C3

Isomeric SMILES

CN1C2C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O.CN(C)CCOC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C19H19NO3.C9H12N4O4/c1-20(2)10-11-22-15-8-9-16-17(21)13-18(23-19(16)12-15)14-6-4-3-5-7-14;1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h3-9,12-13H,10-11H2,1-2H3;4,6-7H,3H2,1-2H3,(H,14,15)