4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]phthalaldehyde

Systemtic Name: 4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]phthalaldehyde Openeye Name: 4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]phthalaldehyde CAS Name: 4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]phthalaldehyde IUPAC Name: 4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]phthalaldehyde Traditional Name: 4-[(2-amino-4-keto-1H-pteridin-6-yl)methylamino]phthalaldehyde Formula: C15H12N6O3 MolecularWeight: 324.29418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCC2=CN=C3C(=N2)C(=O)N=C(N3)N)C=O)C=O

Isomeric SMILES

C1=CC(=C(C=C1NCC2=CN=C3C(=N2)C(=O)N=C(N3)N)C=O)C=O

InChI

InChI=1S/C15H12N6O3/c16-15-20-13-12(14(24)21-15)19-11(5-18-13)4-17-10-2-1-8(6-22)9(3-10)7-23/h1-3,5-7,17H,4H2,(H3,16,18,20,21,24)