2-(3-nitrophenyl)-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine

Systemtic Name: 2-(3-nitrophenyl)-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine Openeye Name: 2-(3-nitrophenyl)-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine CAS Name: 2-(3-nitrophenyl)-3-(1-piperazin-4-iumylmethyl)imidazo[1,2-a]pyridine IUPAC Name: 2-(3-nitrophenyl)-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine Traditional Name: 2-(3-nitrophenyl)-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine Formula: C18H20N5O2+ MolecularWeight: 338.3837

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC2=C(N=C3N2C=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH2+]1)CC2=C(N=C3N2C=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O2/c24-23(25)15-5-3-4-14(12-15)18-16(13-21-10-7-19-8-11-21)22-9-2-1-6-17(22)20-18/h1-6,9,12,19H,7-8,10-11,13H2/p+1