N-[1-(4-nitrophenyl)but-3-ynyl]aniline

Systemtic Name: N-[1-(4-nitrophenyl)but-3-ynyl]aniline Openeye Name: N-[1-(4-nitrophenyl)but-3-ynyl]aniline CAS Name: N-[1-(4-nitrophenyl)but-3-ynyl]aniline IUPAC Name: N-[1-(4-nitrophenyl)but-3-ynyl]aniline Traditional Name: 1-(4-nitrophenyl)but-3-ynyl-phenyl-amine Formula: C16H14N2O2 MolecularWeight: 266.29456

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC(C1=CC=C(C=C1)[N+](=O)[O-])NC2=CC=CC=C2

Isomeric SMILES

C#CCC(C1=CC=C(C=C1)[N+](=O)[O-])NC2=CC=CC=C2

InChI

InChI=1S/C16H14N2O2/c1-2-6-16(17-14-7-4-3-5-8-14)13-9-11-15(12-10-13)18(19)20/h1,3-5,7-12,16-17H,6H2