4-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7-propan-2-yl-4,5-dihydropurin-8-yl]oxy]benzaldehyde

Systemtic Name: 4-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7-propan-2-yl-4,5-dihydropurin-8-yl]oxy]benzaldehyde Openeye Name: 4-[(7-isopropyl-1,3-dimethyl-2,6-dioxo-4,5-dihydropurin-8-yl)oxy]benzaldehyde CAS Name: 4-[(1,3-dimethyl-2,6-dioxo-7-propan-2-yl-4,5-dihydropurin-8-yl)oxy]benzaldehyde IUPAC Name: 4-[(1,3-dimethyl-2,6-dioxo-7-propan-2-yl-4,5-dihydropurin-8-yl)oxy]benzaldehyde Traditional Name: 4-[(7-isopropyl-2,6-diketo-1,3-dimethyl-4,5-dihydropurin-8-yl)oxy]benzaldehyde Formula: C17H20N4O4 MolecularWeight: 344.3651

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2C(N=C1OC3=CC=C(C=C3)C=O)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CC(C)N1C2C(N=C1OC3=CC=C(C=C3)C=O)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C17H20N4O4/c1-10(2)21-13-14(19(3)17(24)20(4)15(13)23)18-16(21)25-12-7-5-11(9-22)6-8-12/h5-10,13-14H,1-4H3