3-[(E)-2-phenylethenyl]purin-6-amine chloride

Systemtic Name: 3-[(E)-2-phenylethenyl]purin-6-amine chloride Openeye Name: 3-[(E)-styryl]purin-6-amine chloride CAS Name: 3-[(E)-2-phenylethenyl]-6-purinamine chloride IUPAC Name: 3-[(E)-2-phenylethenyl]purin-6-amine chloride Traditional Name: [3-[(E)-styryl]purin-6-yl]amine chloride Formula: C13H11ClN5- MolecularWeight: 272.71294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CN2C=NC(=C3C2=NC=N3)N.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/N2C=NC(=C3C2=NC=N3)N.[Cl-]

InChI

InChI=1S/C13H11N5.ClH/c14-12-11-13(16-8-15-11)18(9-17-12)7-6-10-4-2-1-3-5-10;/h1-9H,14H2;1H/p-1/b7-6+;