2-[7,8-dimethyl-2,4-bis(oxidanylidene)-1H-benzo[g]pteridin-10-ium-10-yl]ethyl ethanoate

Systemtic Name: 2-[7,8-dimethyl-2,4-bis(oxidanylidene)-1H-benzo[g]pteridin-10-ium-10-yl]ethyl ethanoate Openeye Name: 2-(7,8-dimethyl-2,4-dioxo-1H-benzo[g]pteridin-10-ium-10-yl)ethyl acetate CAS Name: acetic acid 2-(7,8-dimethyl-2,4-dioxo-1H-benzo[g]pteridin-10-ium-10-yl)ethyl ester IUPAC Name: 2-(7,8-dimethyl-2,4-dioxo-1H-benzo[g]pteridin-10-ium-10-yl)ethyl acetate Traditional Name: acetic acid 2-(2,4-diketo-7,8-dimethyl-1H-benzo[g]pteridin-10-ium-10-yl)ethyl ester Formula: C16H17N4O4+ MolecularWeight: 329.33058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)[N+](=C3C(=N2)C(=O)NC(=O)N3)CCOC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1C)[N+](=C3C(=N2)C(=O)NC(=O)N3)CCOC(=O)C

InChI

InChI=1S/C16H16N4O4/c1-8-6-11-12(7-9(8)2)20(4-5-24-10(3)21)14-13(17-11)15(22)19-16(23)18-14/h6-7H,4-5H2,1-3H3,(H,19,22,23)/p+1