2-[1-[(3-ethynylphenyl)amino]ethyl]-4-methyl-phenol

Systemtic Name: 2-[1-[(3-ethynylphenyl)amino]ethyl]-4-methyl-phenol Openeye Name: 2-[1-(3-ethynylanilino)ethyl]-4-methyl-phenol CAS Name: 2-[1-(3-ethynylanilino)ethyl]-4-methylphenol IUPAC Name: 2-[1-(3-ethynylanilino)ethyl]-4-methylphenol Traditional Name: 2-[1-(3-ethynylanilino)ethyl]-4-methyl-phenol Formula: C17H17NO MolecularWeight: 251.32298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(C)NC2=CC=CC(=C2)C#C

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(C)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C17H17NO/c1-4-14-6-5-7-15(11-14)18-13(3)16-10-12(2)8-9-17(16)19/h1,5-11,13,18-19H,2-3H3