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

Systemtic Name: N-[6-[4-[3-(furan-2-ylmethoxy)-2-oxidanyl-propyl]piperazin-1-yl]pyridin-3-yl]-2-methyl-benzamide Openeye Name: N-[6-[4-[3-(2-furylmethoxy)-2-hydroxy-propyl]piperazin-1-yl]-3-pyridyl]-2-methyl-benzamide CAS Name: N-[6-[4-[3-(2-furanylmethoxy)-2-hydroxypropyl]-1-piperazinyl]-3-pyridinyl]-2-methylbenzamide IUPAC Name: N-[6-[4-[3-(furan-2-ylmethoxy)-2-hydroxypropyl]piperazin-1-yl]pyridin-3-yl]-2-methylbenzamide Traditional Name: N-[6-[4-[3-(2-furfuryloxy)-2-hydroxy-propyl]piperazino]-3-pyridyl]-2-methyl-benzamide Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(COCC4=CC=CO4)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(COCC4=CC=CO4)O

InChI

InChI=1S/C25H30N4O4/c1-19-5-2-3-7-23(19)25(31)27-20-8-9-24(26-15-20)29-12-10-28(11-13-29)16-21(30)17-32-18-22-6-4-14-33-22/h2-9,14-15,21,30H,10-13,16-18H2,1H3,(H,27,31)