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

Systemtic Name: N-[1-(4-butylphenyl)ethyl]-3-ethynyl-aniline Openeye Name: N-[1-(4-butylphenyl)ethyl]-3-ethynyl-aniline CAS Name: N-[1-(4-butylphenyl)ethyl]-3-ethynylaniline IUPAC Name: N-[1-(4-butylphenyl)ethyl]-3-ethynylaniline Traditional Name: 1-(4-butylphenyl)ethyl-(3-ethynylphenyl)amine Formula: C20H23N MolecularWeight: 277.40332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(C)NC2=CC=CC(=C2)C#C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(C)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C20H23N/c1-4-6-8-18-11-13-19(14-12-18)16(3)21-20-10-7-9-17(5-2)15-20/h2,7,9-16,21H,4,6,8H2,1,3H3