methyl 3-[8-chloranyl-7-(2-chlorophenyl)-1-methyl-2,6-bis(oxidanylidene)purin-3-yl]-2,2-dimethyl-propanoate

Systemtic Name: methyl 3-[8-chloranyl-7-(2-chlorophenyl)-1-methyl-2,6-bis(oxidanylidene)purin-3-yl]-2,2-dimethyl-propanoate Openeye Name: methyl 3-[8-chloro-7-(2-chlorophenyl)-1-methyl-2,6-dioxo-purin-3-yl]-2,2-dimethyl-propanoate CAS Name: 3-[8-chloro-7-(2-chlorophenyl)-1-methyl-2,6-dioxo-3-purinyl]-2,2-dimethylpropanoic acid methyl ester IUPAC Name: methyl 3-[8-chloro-7-(2-chlorophenyl)-1-methyl-2,6-dioxopurin-3-yl]-2,2-dimethylpropanoate Traditional Name: 3-[8-chloro-7-(2-chlorophenyl)-2,6-diketo-1-methyl-purin-3-yl]-2,2-dimethyl-propionic acid methyl ester Formula: C18H18Cl2N4O4 MolecularWeight: 425.26592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)C3=CC=CC=C3Cl)C(=O)OC

Isomeric SMILES

CC(C)(CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)C3=CC=CC=C3Cl)C(=O)OC

InChI

InChI=1S/C18H18Cl2N4O4/c1-18(2,15(26)28-4)9-23-13-12(14(25)22(3)17(23)27)24(16(20)21-13)11-8-6-5-7-10(11)19/h5-8H,9H2,1-4H3