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

Systemtic Name: N-[6-[4-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]pyridin-3-yl]-4-methoxy-benzamide Openeye Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxy-propyl]piperazin-1-yl]-3-pyridyl]-4-methoxy-benzamide CAS Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxypropyl]-1-piperazinyl]-3-pyridinyl]-4-methoxybenzamide IUPAC Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]pyridin-3-yl]-4-methoxybenzamide Traditional Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxy-propyl]piperazino]-3-pyridyl]-4-methoxy-benzamide Formula: C26H29ClN4O4 MolecularWeight: 496.98586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(COC4=CC=C(C=C4)Cl)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(COC4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C26H29ClN4O4/c1-34-23-7-2-19(3-8-23)26(33)29-21-6-11-25(28-16-21)31-14-12-30(13-15-31)17-22(32)18-35-24-9-4-20(27)5-10-24/h2-11,16,22,32H,12-15,17-18H2,1H3,(H,29,33)