2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]-1-(2-nitrophenyl)ethanone

Systemtic Name: 2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]-1-(2-nitrophenyl)ethanone Openeye Name: 2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]-1-(2-nitrophenyl)ethanone CAS Name: 2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methylamino]-1-(2-nitrophenyl)ethanone IUPAC Name: 2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methylamino]-1-(2-nitrophenyl)ethanone Traditional Name: 2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]-1-(2-nitrophenyl)ethanone Formula: C18H22N2O3 MolecularWeight: 314.37888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O3/c1-18(2,3)12-8-5-9-13-19(4)14-17(21)15-10-6-7-11-16(15)20(22)23/h5-7,9-11H,13-14H2,1-4H3/b9-5+