8-acetamido-3-(3-methoxypropyl)-4-oxidanylidene-benzo[g]pteridin-2-olate

Systemtic Name: 8-acetamido-3-(3-methoxypropyl)-4-oxidanylidene-benzo[g]pteridin-2-olate Openeye Name: 8-acetamido-3-(3-methoxypropyl)-4-oxo-benzo[g]pteridin-2-olate CAS Name: 8-acetamido-3-(3-methoxypropyl)-4-oxo-2-benzo[g]pteridinolate IUPAC Name: 8-acetamido-3-(3-methoxypropyl)-4-oxobenzo[g]pteridin-2-olate Traditional Name: 8-acetamido-4-keto-3-(3-methoxypropyl)benzo[g]pteridin-2-olate Formula: C16H16N5O4- MolecularWeight: 342.32934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C3C(=N2)N=C(N(C3=O)CCCOC)[O-]

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C3C(=N2)N=C(N(C3=O)CCCOC)[O-]

InChI

InChI=1S/C16H17N5O4/c1-9(22)17-10-4-5-11-12(8-10)19-14-13(18-11)15(23)21(16(24)20-14)6-3-7-25-2/h4-5,8H,3,6-7H2,1-2H3,(H,17,22)(H,19,20,24)/p-1