2-(4-bromophenyl)-4-piperazin-4-ium-1-yl-quinazoline

Systemtic Name: 2-(4-bromophenyl)-4-piperazin-4-ium-1-yl-quinazoline Openeye Name: 2-(4-bromophenyl)-4-piperazin-4-ium-1-yl-quinazoline CAS Name: 2-(4-bromophenyl)-4-(1-piperazin-4-iumyl)quinazoline IUPAC Name: 2-(4-bromophenyl)-4-piperazin-4-ium-1-ylquinazoline Traditional Name: 2-(4-bromophenyl)-4-piperazin-4-ium-1-yl-quinazoline Formula: C18H18BrN4+ MolecularWeight: 370.26632

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

InChI

InChI=1S/C18H17BrN4/c19-14-7-5-13(6-8-14)17-21-16-4-2-1-3-15(16)18(22-17)23-11-9-20-10-12-23/h1-8,20H,9-12H2/p+1