ethyl 4-[7-bromanyl-6-(4-methoxyphenyl)-1-methyl-2,4-bis(oxidanylidene)pteridin-3-yl]butanoate

Systemtic Name: ethyl 4-[7-bromanyl-6-(4-methoxyphenyl)-1-methyl-2,4-bis(oxidanylidene)pteridin-3-yl]butanoate Openeye Name: ethyl 4-[7-bromo-6-(4-methoxyphenyl)-1-methyl-2,4-dioxo-pteridin-3-yl]butanoate CAS Name: 4-[7-bromo-6-(4-methoxyphenyl)-1-methyl-2,4-dioxo-3-pteridinyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[7-bromo-6-(4-methoxyphenyl)-1-methyl-2,4-dioxopteridin-3-yl]butanoate Traditional Name: 4-[7-bromo-2,4-diketo-6-(4-methoxyphenyl)-1-methyl-pteridin-3-yl]butyric acid ethyl ester Formula: C20H21BrN4O5 MolecularWeight: 477.30854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=O)C2=C(N=C(C(=N2)C3=CC=C(C=C3)OC)Br)N(C1=O)C

Isomeric SMILES

CCOC(=O)CCCN1C(=O)C2=C(N=C(C(=N2)C3=CC=C(C=C3)OC)Br)N(C1=O)C

InChI

InChI=1S/C20H21BrN4O5/c1-4-30-14(26)6-5-11-25-19(27)16-18(24(2)20(25)28)23-17(21)15(22-16)12-7-9-13(29-3)10-8-12/h7-10H,4-6,11H2,1-3H3