6-[4-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[3-(4-chlorophenoxy)-2-hydroxy-propyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-[3-(4-chlorophenoxy)-2-hydroxypropyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[3-(4-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-[3-(4-chlorophenoxy)-2-hydroxy-propyl]piperazino]nicotinonitrile Formula: C19H21ClN4O2 MolecularWeight: 372.84864

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)Cl)O)C3=NC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)Cl)O)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C19H21ClN4O2/c20-16-2-4-18(5-3-16)26-14-17(25)13-23-7-9-24(10-8-23)19-6-1-15(11-21)12-22-19/h1-6,12,17,25H,7-10,13-14H2