1-buta-1,3-diynyl-4-nitro-benzene; N,N-dimethylaniline

Systemtic Name: 1-buta-1,3-diynyl-4-nitro-benzene; N,N-dimethylaniline Openeye Name: 1-buta-1,3-diynyl-4-nitro-benzene; N,N-dimethylaniline CAS Name: 1-buta-1,3-diynyl-4-nitrobenzene; N,N-dimethylaniline IUPAC Name: 1-buta-1,3-diynyl-4-nitrobenzene; N,N-dimethylaniline Traditional Name: 1-buta-1,3-diynyl-4-nitro-benzene; dimethyl(phenyl)amine Formula: C18H16N2O2 MolecularWeight: 292.33184

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC=C1.C#CC#CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=CC=CC=C1.C#CC#CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C10H5NO2.C8H11N/c1-2-3-4-9-5-7-10(8-6-9)11(12)13;1-9(2)8-6-4-3-5-7-8/h1,5-8H;3-7H,1-2H3