ethyl 7,8-dibutoxy-4-oxidanylidene-1H-benzo[g]pteridine-2-carboxylate

Systemtic Name: ethyl 7,8-dibutoxy-4-oxidanylidene-1H-benzo[g]pteridine-2-carboxylate Openeye Name: ethyl 7,8-dibutoxy-4-oxo-1H-benzo[g]pteridine-2-carboxylate CAS Name: 7,8-dibutoxy-4-oxo-1H-benzo[g]pteridine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7,8-dibutoxy-4-oxo-1H-benzo[g]pteridine-2-carboxylate Traditional Name: 7,8-dibutoxy-4-keto-1H-benzo[g]pteridine-2-carboxylic acid ethyl ester Formula: C21H26N4O5 MolecularWeight: 414.45494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C2C(=C1)N=C3C(=N2)NC(=NC3=O)C(=O)OCC)OCCCC

Isomeric SMILES

CCCCOC1=C(C=C2C(=C1)N=C3C(=N2)NC(=NC3=O)C(=O)OCC)OCCCC

InChI

InChI=1S/C21H26N4O5/c1-4-7-9-29-15-11-13-14(12-16(15)30-10-8-5-2)23-18-17(22-13)20(26)25-19(24-18)21(27)28-6-3/h11-12H,4-10H2,1-3H3,(H,23,24,25,26)