8-[(E)-2-(3-chlorophenyl)ethenyl]-3-methyl-1-propyl-7H-purine-2,6-dione

Systemtic Name: 8-[(E)-2-(3-chlorophenyl)ethenyl]-3-methyl-1-propyl-7H-purine-2,6-dione Openeye Name: 8-[(E)-2-(3-chlorophenyl)vinyl]-3-methyl-1-propyl-7H-purine-2,6-dione CAS Name: 8-[(E)-2-(3-chlorophenyl)ethenyl]-3-methyl-1-propyl-7H-purine-2,6-dione IUPAC Name: 8-[(E)-2-(3-chlorophenyl)ethenyl]-3-methyl-1-propyl-7H-purine-2,6-dione Traditional Name: 8-[(E)-2-(3-chlorophenyl)vinyl]-3-methyl-1-propyl-7H-purine-2,6-quinone Formula: C17H17ClN4O2 MolecularWeight: 344.79548

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)C=CC3=CC(=CC=C3)Cl)N(C1=O)C

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)/C=C/C3=CC(=CC=C3)Cl)N(C1=O)C

InChI

InChI=1S/C17H17ClN4O2/c1-3-9-22-16(23)14-15(21(2)17(22)24)20-13(19-14)8-7-11-5-4-6-12(18)10-11/h4-8,10H,3,9H2,1-2H3,(H,19,20)/b8-7+