3,8-dimethyl-6-[(E)-1-phenylprop-1-en-2-yl]-1H-pteridin-8-ium-2,4-dione

Systemtic Name: 3,8-dimethyl-6-[(E)-1-phenylprop-1-en-2-yl]-1H-pteridin-8-ium-2,4-dione Openeye Name: 3,8-dimethyl-6-[(E)-1-methyl-2-phenyl-vinyl]-1H-pteridin-8-ium-2,4-dione CAS Name: 3,8-dimethyl-6-[(E)-1-phenylprop-1-en-2-yl]-1H-pteridin-8-ium-2,4-dione IUPAC Name: 3,8-dimethyl-6-[(E)-1-phenylprop-1-en-2-yl]-1H-pteridin-8-ium-2,4-dione Traditional Name: 3,8-dimethyl-6-[(E)-1-methyl-2-phenyl-vinyl]-1H-pteridin-8-ium-2,4-quinone Formula: C17H17N4O2+ MolecularWeight: 309.34248

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C2=C[N+](=C3C(=N2)C(=O)N(C(=O)N3)C)C

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/C2=C[N+](=C3C(=N2)C(=O)N(C(=O)N3)C)C

InChI

InChI=1S/C17H16N4O2/c1-11(9-12-7-5-4-6-8-12)13-10-20(2)15-14(18-13)16(22)21(3)17(23)19-15/h4-10H,1-3H3/p+1/b11-9+