4-[[(3-ethynylphenyl)amino]methyl]benzene-1,3-diol

Systemtic Name: 4-[[(3-ethynylphenyl)amino]methyl]benzene-1,3-diol Openeye Name: 4-[(3-ethynylanilino)methyl]benzene-1,3-diol CAS Name: 4-[(3-ethynylanilino)methyl]benzene-1,3-diol IUPAC Name: 4-[(3-ethynylanilino)methyl]benzene-1,3-diol Traditional Name: 4-[(3-ethynylanilino)methyl]resorcinol Formula: C15H13NO2 MolecularWeight: 239.26922

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NCC2=C(C=C(C=C2)O)O

Isomeric SMILES

C#CC1=CC(=CC=C1)NCC2=C(C=C(C=C2)O)O

InChI

InChI=1S/C15H13NO2/c1-2-11-4-3-5-13(8-11)16-10-12-6-7-14(17)9-15(12)18/h1,3-9,16-18H,10H2