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

Systemtic Name: N-[6-[4-[3-(2-methylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]pyridin-3-yl]cyclopropanecarboxamide Openeye Name: N-[6-[4-[2-hydroxy-3-(2-methylphenoxy)propyl]piperazin-1-yl]-3-pyridyl]cyclopropanecarboxamide CAS Name: N-[6-[4-[2-hydroxy-3-(2-methylphenoxy)propyl]-1-piperazinyl]-3-pyridinyl]cyclopropanecarboxamide IUPAC Name: N-[6-[4-[2-hydroxy-3-(2-methylphenoxy)propyl]piperazin-1-yl]pyridin-3-yl]cyclopropanecarboxamide Traditional Name: N-[6-[4-[2-hydroxy-3-(2-methylphenoxy)propyl]piperazino]-3-pyridyl]cyclopropanecarboxamide Formula: C23H30N4O3 MolecularWeight: 410.5093

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(CN2CCN(CC2)C3=NC=C(C=C3)NC(=O)C4CC4)O

Isomeric SMILES

CC1=CC=CC=C1OCC(CN2CCN(CC2)C3=NC=C(C=C3)NC(=O)C4CC4)O

InChI

InChI=1S/C23H30N4O3/c1-17-4-2-3-5-21(17)30-16-20(28)15-26-10-12-27(13-11-26)22-9-8-19(14-24-22)25-23(29)18-6-7-18/h2-5,8-9,14,18,20,28H,6-7,10-13,15-16H2,1H3,(H,25,29)