4-nitro-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]benzamide

Systemtic Name: 4-nitro-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]benzamide Openeye Name: 4-nitro-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]benzamide CAS Name: 4-nitro-N-[1-[2-(1-piperidin-1-iumyl)ethyl]-2-benzimidazolyl]benzamide IUPAC Name: 4-nitro-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]benzamide Traditional Name: 4-nitro-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]benzamide Formula: C21H24N5O3+ MolecularWeight: 394.44696

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C3=CC=CC=C3N=C2NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CCN2C3=CC=CC=C3N=C2NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O3/c27-20(16-8-10-17(11-9-16)26(28)29)23-21-22-18-6-2-3-7-19(18)25(21)15-14-24-12-4-1-5-13-24/h2-3,6-11H,1,4-5,12-15H2,(H,22,23,27)/p+1