3-[5-[2-(4-chloranylphenoxy)piperidin-1-yl]pent-1-ynyl]aniline

Systemtic Name: 3-[5-[2-(4-chloranylphenoxy)piperidin-1-yl]pent-1-ynyl]aniline Openeye Name: 3-[5-[2-(4-chlorophenoxy)-1-piperidyl]pent-1-ynyl]aniline CAS Name: 3-[5-[2-(4-chlorophenoxy)-1-piperidinyl]pent-1-ynyl]aniline IUPAC Name: 3-[5-[2-(4-chlorophenoxy)piperidin-1-yl]pent-1-ynyl]aniline Traditional Name: [3-[5-[2-(4-chlorophenoxy)piperidino]pent-1-ynyl]phenyl]amine Formula: C22H25ClN2O MolecularWeight: 368.8997

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)OC2=CC=C(C=C2)Cl)CCCC#CC3=CC(=CC=C3)N

Isomeric SMILES

C1CCN(C(C1)OC2=CC=C(C=C2)Cl)CCCC#CC3=CC(=CC=C3)N

InChI

InChI=1S/C22H25ClN2O/c23-19-11-13-21(14-12-19)26-22-10-3-5-16-25(22)15-4-1-2-7-18-8-6-9-20(24)17-18/h6,8-9,11-14,17,22H,1,3-5,10,15-16,24H2