3-[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl)piperazin-1-yl]-N-(2-nitrophenyl)propanamide

Systemtic Name: 3-[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl)piperazin-1-yl]-N-(2-nitrophenyl)propanamide Openeye Name: 3-[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl)piperazin-1-yl]-N-(2-nitrophenyl)propanamide CAS Name: 3-[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl)-1-piperazinyl]-N-(2-nitrophenyl)propanamide IUPAC Name: 3-[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl)piperazin-1-yl]-N-(2-nitrophenyl)propanamide Traditional Name: 3-[4-(1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl)piperazino]-N-(2-nitrophenyl)propionamide Formula: C21H25N6O3+ MolecularWeight: 409.4616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=CC=CC=C2[N+](=O)[O-])CC3=C[N+]4=CC=CC=C4N3

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=CC=CC=C2[N+](=O)[O-])CC3=C[N+]4=CC=CC=C4N3

InChI

InChI=1S/C21H24N6O3/c28-21(23-18-5-1-2-6-19(18)27(29)30)8-10-24-11-13-25(14-12-24)15-17-16-26-9-4-3-7-20(26)22-17/h1-7,9,16H,8,10-15H2,(H,23,28)/p+1