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

Systemtic Name: N-[6-[4-(2-oxidanyl-3-prop-2-enoxy-propyl)piperazin-1-yl]pyridin-3-yl]benzamide Openeye Name: N-[6-[4-(3-allyloxy-2-hydroxy-propyl)piperazin-1-yl]-3-pyridyl]benzamide CAS Name: N-[6-[4-(2-hydroxy-3-prop-2-enoxypropyl)-1-piperazinyl]-3-pyridinyl]benzamide IUPAC Name: N-[6-[4-(2-hydroxy-3-prop-2-enoxypropyl)piperazin-1-yl]pyridin-3-yl]benzamide Traditional Name: N-[6-[4-(3-allyloxy-2-hydroxy-propyl)piperazino]-3-pyridyl]benzamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O3/c1-2-14-29-17-20(27)16-25-10-12-26(13-11-25)21-9-8-19(15-23-21)24-22(28)18-6-4-3-5-7-18/h2-9,15,20,27H,1,10-14,16-17H2,(H,24,28)