3-ethynyl-N-[1-(3-nitrophenyl)propyl]aniline

Systemtic Name: 3-ethynyl-N-[1-(3-nitrophenyl)propyl]aniline Openeye Name: 3-ethynyl-N-[1-(3-nitrophenyl)propyl]aniline CAS Name: 3-ethynyl-N-[1-(3-nitrophenyl)propyl]aniline IUPAC Name: 3-ethynyl-N-[1-(3-nitrophenyl)propyl]aniline Traditional Name: (3-ethynylphenyl)-[1-(3-nitrophenyl)propyl]amine Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O2/c1-3-13-7-5-9-15(11-13)18-17(4-2)14-8-6-10-16(12-14)19(20)21/h1,5-12,17-18H,4H2,2H3