2-(4-chloranylphenoxy)-N-[6-[4-(2-oxidanyl-3-prop-2-ynoxy-propyl)piperazin-1-yl]pyridin-3-yl]ethanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[6-[4-(2-oxidanyl-3-prop-2-ynoxy-propyl)piperazin-1-yl]pyridin-3-yl]ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-[6-[4-(2-hydroxy-3-prop-2-ynoxy-propyl)piperazin-1-yl]-3-pyridyl]acetamide CAS Name: 2-(4-chlorophenoxy)-N-[6-[4-(2-hydroxy-3-prop-2-ynoxypropyl)-1-piperazinyl]-3-pyridinyl]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-[6-[4-(2-hydroxy-3-prop-2-ynoxypropyl)piperazin-1-yl]pyridin-3-yl]acetamide Traditional Name: 2-(4-chlorophenoxy)-N-[6-[4-(2-hydroxy-3-propargyloxy-propyl)piperazino]-3-pyridyl]acetamide Formula: C23H27ClN4O4 MolecularWeight: 458.93788

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOCC(CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)COC3=CC=C(C=C3)Cl)O

Isomeric SMILES

C#CCOCC(CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)COC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C23H27ClN4O4/c1-2-13-31-16-20(29)15-27-9-11-28(12-10-27)22-8-5-19(14-25-22)26-23(30)17-32-21-6-3-18(24)4-7-21/h1,3-8,14,20,29H,9-13,15-17H2,(H,26,30)