4-bromanyl-2-[1-[(3-ethynylphenyl)amino]propyl]phenol

Systemtic Name: 4-bromanyl-2-[1-[(3-ethynylphenyl)amino]propyl]phenol Openeye Name: 4-bromo-2-[1-(3-ethynylanilino)propyl]phenol CAS Name: 4-bromo-2-[1-(3-ethynylanilino)propyl]phenol IUPAC Name: 4-bromo-2-[1-(3-ethynylanilino)propyl]phenol Traditional Name: 4-bromo-2-[1-(3-ethynylanilino)propyl]phenol Formula: C17H16BrNO MolecularWeight: 330.21904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1)Br)O)NC2=CC=CC(=C2)C#C

Isomeric SMILES

CCC(C1=C(C=CC(=C1)Br)O)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C17H16BrNO/c1-3-12-6-5-7-14(10-12)19-16(4-2)15-11-13(18)8-9-17(15)20/h1,5-11,16,19-20H,4H2,2H3