6-bromanyl-2-(3-nitrophenyl)-3-(piperazine-1,4-diium-1-ylmethyl)imidazo[1,2-a]pyridine

Systemtic Name: 6-bromanyl-2-(3-nitrophenyl)-3-(piperazine-1,4-diium-1-ylmethyl)imidazo[1,2-a]pyridine Openeye Name: 6-bromo-2-(3-nitrophenyl)-3-(piperazine-1,4-diium-1-ylmethyl)imidazo[1,2-a]pyridine CAS Name: 6-bromo-2-(3-nitrophenyl)-3-(1-piperazine-1,4-diiumylmethyl)imidazo[1,2-a]pyridine IUPAC Name: 6-bromo-2-(3-nitrophenyl)-3-(piperazine-1,4-diium-1-ylmethyl)imidazo[1,2-a]pyridine Traditional Name: 6-bromo-2-(3-nitrophenyl)-3-(piperazine-1,4-diium-1-ylmethyl)imidazo[1,2-a]pyridine Formula: C18H20BrN5O2+2 MolecularWeight: 418.2877

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CC2=C(N=C3N2C=C(C=C3)Br)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CC2=C(N=C3N2C=C(C=C3)Br)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H18BrN5O2/c19-14-4-5-17-21-18(13-2-1-3-15(10-13)24(25)26)16(23(17)11-14)12-22-8-6-20-7-9-22/h1-5,10-11,20H,6-9,12H2/p+2