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4-oxidanylidene-3-phenethyl-8-(propanoylamino)benzo[g]pteridin-2-olate

4-oxidanylidene-3-phenethyl-8-(propanoylamino)benzo[g]pteridin-2-olate

Systemtic Name:4-oxidanylidene-3-phenethyl-8-(propanoylamino)benzo[g]pteridin-2-olate
Openeye Name:4-oxo-3-phenethyl-8-(propanoylamino)benzo[g]pteridin-2-olate
CAS Name:4-oxo-8-(1-oxopropylamino)-3-phenethyl-2-benzo[g]pteridinolate
IUPAC Name:4-oxo-3-phenethyl-8-(propanoylamino)benzo[g]pteridin-2-olate
Traditional Name:4-keto-3-phenethyl-8-propionamido-benzo[g]pteridin-2-olate
Formula: C21H18N5O3-
MolecularWeight: 388.39932
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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(C=C1)N=C3C(=N2)N=C(N(C3=O)CCC4=CC=CC=C4)[O-]


Isomeric SMILES

CCC(=O)NC1=CC2=C(C=C1)N=C3C(=N2)N=C(N(C3=O)CCC4=CC=CC=C4)[O-]


InChI

InChI=1S/C21H19N5O3/c1-2-17(27)22-14-8-9-15-16(12-14)24-19-18(23-15)20(28)26(21(29)25-19)11-10-13-6-4-3-5-7-13/h3-9,12H,2,10-11H2,1H3,(H,22,27)(H,24,25,29)/p-1


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