6-iodanyl-4-piperazin-4-ium-1-yl-quinazoline

Systemtic Name: 6-iodanyl-4-piperazin-4-ium-1-yl-quinazoline Openeye Name: 6-iodo-4-piperazin-4-ium-1-yl-quinazoline CAS Name: 6-iodo-4-(1-piperazin-4-iumyl)quinazoline IUPAC Name: 6-iodo-4-piperazin-4-ium-1-ylquinazoline Traditional Name: 6-iodo-4-piperazin-4-ium-1-yl-quinazoline Formula: C12H14IN4+ MolecularWeight: 341.17083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC=NC3=C2C=C(C=C3)I

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC=NC3=C2C=C(C=C3)I

InChI

InChI=1S/C12H13IN4/c13-9-1-2-11-10(7-9)12(16-8-15-11)17-5-3-14-4-6-17/h1-2,7-8,14H,3-6H2/p+1