propan-2-yl 4-[7-chloranyl-1-methyl-2,4-bis(oxidanylidene)-6-phenyl-pteridin-3-yl]butanoate

Systemtic Name: propan-2-yl 4-[7-chloranyl-1-methyl-2,4-bis(oxidanylidene)-6-phenyl-pteridin-3-yl]butanoate Openeye Name: isopropyl 4-(7-chloro-1-methyl-2,4-dioxo-6-phenyl-pteridin-3-yl)butanoate CAS Name: 4-(7-chloro-1-methyl-2,4-dioxo-6-phenyl-3-pteridinyl)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(7-chloro-1-methyl-2,4-dioxo-6-phenylpteridin-3-yl)butanoate Traditional Name: 4-(7-chloro-2,4-diketo-1-methyl-6-phenyl-pteridin-3-yl)butyric acid isopropyl ester Formula: C20H21ClN4O4 MolecularWeight: 416.85814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O4/c1-12(2)29-14(26)10-7-11-25-19(27)16-18(24(3)20(25)28)23-17(21)15(22-16)13-8-5-4-6-9-13/h4-6,8-9,12H,7,10-11H2,1-3H3