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

Systemtic Name: N-[6-[4-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]pyridin-3-yl]benzamide Openeye Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxy-propyl]piperazin-1-yl]-3-pyridyl]benzamide CAS Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxypropyl]-1-piperazinyl]-3-pyridinyl]benzamide IUPAC Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]pyridin-3-yl]benzamide Traditional Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxy-propyl]piperazino]-3-pyridyl]benzamide Formula: C25H27ClN4O3 MolecularWeight: 466.95988

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)Cl)O)C3=NC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)Cl)O)C3=NC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H27ClN4O3/c26-20-6-9-23(10-7-20)33-18-22(31)17-29-12-14-30(15-13-29)24-11-8-21(16-27-24)28-25(32)19-4-2-1-3-5-19/h1-11,16,22,31H,12-15,17-18H2,(H,28,32)