3-(8-iodanyloctyl)-10-methyl-2,4-bis(oxidanylidene)benzo[g]pteridine-8-carbonitrile

Systemtic Name: 3-(8-iodanyloctyl)-10-methyl-2,4-bis(oxidanylidene)benzo[g]pteridine-8-carbonitrile Openeye Name: 3-(8-iodooctyl)-10-methyl-2,4-dioxo-benzo[g]pteridine-8-carbonitrile CAS Name: 3-(8-iodooctyl)-10-methyl-2,4-dioxo-8-benzo[g]pteridinecarbonitrile IUPAC Name: 3-(8-iodooctyl)-10-methyl-2,4-dioxobenzo[g]pteridine-8-carbonitrile Traditional Name: 3-(8-iodooctyl)-2,4-diketo-10-methyl-benzo[g]pteridine-8-carbonitrile Formula: C20H22IN5O2 MolecularWeight: 491.32545

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C#N)N=C3C1=NC(=O)N(C3=O)CCCCCCCCI

Isomeric SMILES

CN1C2=C(C=CC(=C2)C#N)N=C3C1=NC(=O)N(C3=O)CCCCCCCCI

InChI

InChI=1S/C20H22IN5O2/c1-25-16-12-14(13-22)8-9-15(16)23-17-18(25)24-20(28)26(19(17)27)11-7-5-3-2-4-6-10-21/h8-9,12H,2-7,10-11H2,1H3