2-iodanyl-N-(2-pyridin-2-ylethyl)ethanamide hydrate

Systemtic Name: 2-iodanyl-N-(2-pyridin-2-ylethyl)ethanamide hydrate Openeye Name: 2-iodo-N-[2-(2-pyridyl)ethyl]acetamide hydrate CAS Name: 2-iodo-N-[2-(2-pyridinyl)ethyl]acetamide hydrate IUPAC Name: 2-iodo-N-(2-pyridin-2-ylethyl)acetamide hydrate Traditional Name: 2-iodo-N-[2-(2-pyridyl)ethyl]acetamide hydrate Formula: C9H13IN2O2 MolecularWeight: 308.11619

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCNC(=O)CI.O

Isomeric SMILES

C1=CC=NC(=C1)CCNC(=O)CI.O

InChI

InChI=1S/C9H11IN2O.H2O/c10-7-9(13)12-6-4-8-3-1-2-5-11-8;/h1-3,5H,4,6-7H2,(H,12,13);1H2