N-[(E,2S)-4-nitro-1-phenyl-but-3-en-2-yl]ethanamide

Systemtic Name: N-[(E,2S)-4-nitro-1-phenyl-but-3-en-2-yl]ethanamide Openeye Name: N-[(E,1S)-1-benzyl-3-nitro-allyl]acetamide CAS Name: N-[(E,2S)-4-nitro-1-phenylbut-3-en-2-yl]acetamide IUPAC Name: N-[(E,2S)-4-nitro-1-phenylbut-3-en-2-yl]acetamide Traditional Name: N-[(E,1S)-1-benzyl-3-nitro-allyl]acetamide Formula: C12H14N2O3 MolecularWeight: 234.25116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=CC=C1)C=C[N+](=O)[O-]

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC=CC=C1)/C=C/[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O3/c1-10(15)13-12(7-8-14(16)17)9-11-5-3-2-4-6-11/h2-8,12H,9H2,1H3,(H,13,15)/b8-7+/t12-/m1/s1