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

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

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCC1CC(CCN1OC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)N

Isomeric SMILES

C#CCCC1CC(CCN1OC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)N

InChI

InChI=1S/C21H23ClN2O/c1-2-3-7-20-15-17(16-5-4-6-19(23)14-16)12-13-24(20)25-21-10-8-18(22)9-11-21/h1,4-6,8-11,14,17,20H,3,7,12-13,15,23H2