4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]cyclohex-3-ene-1,1-dicarbaldehyde

Systemtic Name: 4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]cyclohex-3-ene-1,1-dicarbaldehyde Openeye Name: 4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]cyclohex-3-ene-1,1-dicarbaldehyde CAS Name: 4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]cyclohex-3-ene-1,1-dicarboxaldehyde IUPAC Name: 4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]cyclohex-3-ene-1,1-dicarbaldehyde Traditional Name: 4-[(2-amino-4-keto-1H-pteridin-6-yl)methylamino]cyclohex-3-ene-1,1-dicarbaldehyde Formula: C15H16N6O3 MolecularWeight: 328.32594

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1NCC2=CN=C3C(=N2)C(=O)N=C(N3)N)(C=O)C=O

Isomeric SMILES

C1CC(CC=C1NCC2=CN=C3C(=N2)C(=O)N=C(N3)N)(C=O)C=O

InChI

InChI=1S/C15H16N6O3/c16-14-20-12-11(13(24)21-14)19-10(6-18-12)5-17-9-1-3-15(7-22,8-23)4-2-9/h1,6-8,17H,2-5H2,(H3,16,18,20,21,24)