5-[8-cyano-10-methyl-2,4-bis(oxidanylidene)benzo[g]pteridin-3-yl]pentanoic acid

Systemtic Name: 5-[8-cyano-10-methyl-2,4-bis(oxidanylidene)benzo[g]pteridin-3-yl]pentanoic acid Openeye Name: 5-(8-cyano-10-methyl-2,4-dioxo-benzo[g]pteridin-3-yl)pentanoic acid CAS Name: 5-(8-cyano-10-methyl-2,4-dioxo-3-benzo[g]pteridinyl)pentanoic acid IUPAC Name: 5-(8-cyano-10-methyl-2,4-dioxobenzo[g]pteridin-3-yl)pentanoic acid Traditional Name: 5-(8-cyano-2,4-diketo-10-methyl-benzo[g]pteridin-3-yl)valeric acid Formula: C17H15N5O4 MolecularWeight: 353.3321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N5O4/c1-21-12-8-10(9-18)5-6-11(12)19-14-15(21)20-17(26)22(16(14)25)7-3-2-4-13(23)24/h5-6,8H,2-4,7H2,1H3,(H,23,24)