1-[3-nitro-4-(prop-2-ynylamino)phenyl]ethanone

Systemtic Name: 1-[3-nitro-4-(prop-2-ynylamino)phenyl]ethanone Openeye Name: 1-[3-nitro-4-(prop-2-ynylamino)phenyl]ethanone CAS Name: 1-[3-nitro-4-(prop-2-ynylamino)phenyl]ethanone IUPAC Name: 1-[3-nitro-4-(prop-2-ynylamino)phenyl]ethanone Traditional Name: 1-[3-nitro-4-(propargylamino)phenyl]ethanone Formula: C11H10N2O3 MolecularWeight: 218.2087

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)NCC#C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)NCC#C)[N+](=O)[O-]

InChI

InChI=1S/C11H10N2O3/c1-3-6-12-10-5-4-9(8(2)14)7-11(10)13(15)16/h1,4-5,7,12H,6H2,2H3