N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-3-iodanyl-benzamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-3-iodanyl-benzamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-3-iodo-benzamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-3-iodobenzamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-3-iodobenzamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-3-iodo-benzamide Formula: C14H19IN3O2+ MolecularWeight: 388.22403

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC(=CC=C2)I)CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC(=CC=C2)I)CC(=O)N

InChI

InChI=1S/C14H18IN3O2/c15-11-3-1-2-10(8-11)14(20)17-12-4-6-18(7-5-12)9-13(16)19/h1-3,8,12H,4-7,9H2,(H2,16,19)(H,17,20)/p+1