2-chloranyl-N-[(E)-(4-methoxyphenyl)methylideneamino]-7H-purin-6-amine

Systemtic Name: 2-chloranyl-N-[(E)-(4-methoxyphenyl)methylideneamino]-7H-purin-6-amine Openeye Name: 2-chloro-N-[(E)-(4-methoxyphenyl)methyleneamino]-7H-purin-6-amine CAS Name: 2-chloro-N-[(E)-(4-methoxyphenyl)methylideneamino]-7H-purin-6-amine IUPAC Name: 2-chloro-N-[(E)-(4-methoxyphenyl)methylideneamino]-7H-purin-6-amine Traditional Name: (2-chloro-7H-purin-6-yl)-[(E)-p-anisylideneamino]amine Formula: C13H11ClN6O MolecularWeight: 302.71904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=NNC2=NC(=NC3=C2NC=N3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)/C=N/NC2=NC(=NC3=C2NC=N3)Cl

InChI

InChI=1S/C13H11ClN6O/c1-21-9-4-2-8(3-5-9)6-17-20-12-10-11(16-7-15-10)18-13(14)19-12/h2-7H,1H3,(H2,15,16,18,19,20)/b17-6+