3-ethynyl-N-[1-(4-nitrophenyl)ethyl]aniline

Systemtic Name: 3-ethynyl-N-[1-(4-nitrophenyl)ethyl]aniline Openeye Name: 3-ethynyl-N-[1-(4-nitrophenyl)ethyl]aniline CAS Name: 3-ethynyl-N-[1-(4-nitrophenyl)ethyl]aniline IUPAC Name: 3-ethynyl-N-[1-(4-nitrophenyl)ethyl]aniline Traditional Name: (3-ethynylphenyl)-[1-(4-nitrophenyl)ethyl]amine Formula: C16H14N2O2 MolecularWeight: 266.29456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O2/c1-3-13-5-4-6-15(11-13)17-12(2)14-7-9-16(10-8-14)18(19)20/h1,4-12,17H,2H3