2-nitro-N-(2-piperidin-1-ium-1-ylethyl)benzamide

Systemtic Name: 2-nitro-N-(2-piperidin-1-ium-1-ylethyl)benzamide Openeye Name: 2-nitro-N-(2-piperidin-1-ium-1-ylethyl)benzamide CAS Name: 2-nitro-N-[2-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 2-nitro-N-(2-piperidin-1-ium-1-ylethyl)benzamide Traditional Name: 2-nitro-N-(2-piperidin-1-ium-1-ylethyl)benzamide Formula: C14H20N3O3+ MolecularWeight: 278.3269

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O3/c18-14(12-6-2-3-7-13(12)17(19)20)15-8-11-16-9-4-1-5-10-16/h2-3,6-7H,1,4-5,8-11H2,(H,15,18)/p+1