N-[5-(2-bromoethyl)-1-nitro-cyclohexa-2,4-dien-1-yl]ethanamide

Systemtic Name: N-[5-(2-bromoethyl)-1-nitro-cyclohexa-2,4-dien-1-yl]ethanamide Openeye Name: N-[5-(2-bromoethyl)-1-nitro-cyclohexa-2,4-dien-1-yl]acetamide CAS Name: N-[5-(2-bromoethyl)-1-nitro-1-cyclohexa-2,4-dienyl]acetamide IUPAC Name: N-[5-(2-bromoethyl)-1-nitrocyclohexa-2,4-dien-1-yl]acetamide Traditional Name: N-[5-(2-bromoethyl)-1-nitro-cyclohexa-2,4-dien-1-yl]acetamide Formula: C10H13BrN2O3 MolecularWeight: 289.12582

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(CC(=CC=C1)CCBr)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1(CC(=CC=C1)CCBr)[N+](=O)[O-]

InChI

InChI=1S/C10H13BrN2O3/c1-8(14)12-10(13(15)16)5-2-3-9(7-10)4-6-11/h2-3,5H,4,6-7H2,1H3,(H,12,14)