2-[4-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-[2-(4-chlorophenoxy)-2-methyl-propanoyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[2-(4-chlorophenoxy)-2-methyl-1-oxopropyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-[2-(4-chlorophenoxy)-2-methylpropanoyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-[2-(4-chlorophenoxy)-2-methyl-propanoyl]piperazino]nicotinonitrile Formula: C20H21ClN4O2 MolecularWeight: 384.85934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCN(CC1)C2=C(C=CC=N2)C#N)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)N1CCN(CC1)C2=C(C=CC=N2)C#N)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN4O2/c1-20(2,27-17-7-5-16(21)6-8-17)19(26)25-12-10-24(11-13-25)18-15(14-22)4-3-9-23-18/h3-9H,10-13H2,1-2H3