3-[4-[1-(4-chloranylphenoxy)piperidin-2-yl]but-1-ynyl]aniline

Systemtic Name: 3-[4-[1-(4-chloranylphenoxy)piperidin-2-yl]but-1-ynyl]aniline Openeye Name: 3-[4-[1-(4-chlorophenoxy)-2-piperidyl]but-1-ynyl]aniline CAS Name: 3-[4-[1-(4-chlorophenoxy)-2-piperidinyl]but-1-ynyl]aniline IUPAC Name: 3-[4-[1-(4-chlorophenoxy)piperidin-2-yl]but-1-ynyl]aniline Traditional Name: [3-[4-[1-(4-chlorophenoxy)-2-piperidyl]but-1-ynyl]phenyl]amine Formula: C21H23ClN2O MolecularWeight: 354.87312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCC#CC2=CC(=CC=C2)N)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C(C1)CCC#CC2=CC(=CC=C2)N)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN2O/c22-18-11-13-21(14-12-18)25-24-15-4-3-10-20(24)9-2-1-6-17-7-5-8-19(23)16-17/h5,7-8,11-14,16,20H,2-4,9-10,15,23H2