azanylidene-[2-chloranyl-9-(phenylmethyl)purin-6-yl]imino-azanium

Systemtic Name: azanylidene-[2-chloranyl-9-(phenylmethyl)purin-6-yl]imino-azanium Openeye Name: (9-benzyl-2-chloro-purin-6-yl)imino-imino-ammonium CAS Name: [2-chloro-9-(phenylmethyl)-6-purinyl]imino-iminoammonium IUPAC Name: (9-benzyl-2-chloropurin-6-yl)imino-iminoazanium Traditional Name: (9-benzyl-2-chloro-purin-6-yl)imino-imino-ammonium Formula: C12H9ClN7+ MolecularWeight: 286.69976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C(N=C(N=C32)Cl)N=[N+]=N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C(N=C(N=C32)Cl)N=[N+]=N

InChI

InChI=1S/C12H9ClN7/c13-12-16-10(18-19-14)9-11(17-12)20(7-15-9)6-8-4-2-1-3-5-8/h1-5,7,14H,6H2/q+1