tert-butyl 7-[7,8-dimethyl-2,4-bis(oxidanylidene)benzo[g]pteridin-10-yl]heptanoate

Systemtic Name: tert-butyl 7-[7,8-dimethyl-2,4-bis(oxidanylidene)benzo[g]pteridin-10-yl]heptanoate Openeye Name: tert-butyl 7-(7,8-dimethyl-2,4-dioxo-benzo[g]pteridin-10-yl)heptanoate CAS Name: 7-(7,8-dimethyl-2,4-dioxo-10-benzo[g]pteridinyl)heptanoic acid tert-butyl ester IUPAC Name: tert-butyl 7-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)heptanoate Traditional Name: 7-(2,4-diketo-7,8-dimethyl-benzo[g]pteridin-10-yl)enanthic acid tert-butyl ester Formula: C23H30N4O4 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CCCCCCC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CCCCCCC(=O)OC(C)(C)C

InChI

InChI=1S/C23H30N4O4/c1-14-12-16-17(13-15(14)2)27(20-19(24-16)21(29)26-22(30)25-20)11-9-7-6-8-10-18(28)31-23(3,4)5/h12-13H,6-11H2,1-5H3,(H,26,29,30)