3-ethynyl-N-[1-(2-methylphenyl)ethyl]aniline

Systemtic Name: 3-ethynyl-N-[1-(2-methylphenyl)ethyl]aniline Openeye Name: 3-ethynyl-N-[1-(o-tolyl)ethyl]aniline CAS Name: 3-ethynyl-N-[1-(2-methylphenyl)ethyl]aniline IUPAC Name: 3-ethynyl-N-[1-(2-methylphenyl)ethyl]aniline Traditional Name: (3-ethynylphenyl)-[1-(o-tolyl)ethyl]amine Formula: C17H17N MolecularWeight: 235.32358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)NC2=CC=CC(=C2)C#C

Isomeric SMILES

CC1=CC=CC=C1C(C)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C17H17N/c1-4-15-9-7-10-16(12-15)18-14(3)17-11-6-5-8-13(17)2/h1,5-12,14,18H,2-3H3