5-[(E)-4-(4-dimethylaminophenyl)but-1-en-3-ynyl]-2-nitro-phenol

Systemtic Name: 5-[(E)-4-(4-dimethylaminophenyl)but-1-en-3-ynyl]-2-nitro-phenol Openeye Name: 5-[(E)-4-(4-dimethylaminophenyl)but-1-en-3-ynyl]-2-nitro-phenol CAS Name: 5-[(E)-4-(4-dimethylaminophenyl)but-1-en-3-ynyl]-2-nitrophenol IUPAC Name: 5-[(E)-4-(4-dimethylaminophenyl)but-1-en-3-ynyl]-2-nitrophenol Traditional Name: 5-[(E)-4-(4-dimethylaminophenyl)but-1-en-3-ynyl]-2-nitro-phenol Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C#CC=CC2=CC(=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C#C/C=C/C2=CC(=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C18H16N2O3/c1-19(2)16-10-7-14(8-11-16)5-3-4-6-15-9-12-17(20(22)23)18(21)13-15/h4,6-13,21H,1-2H3/b6-4+