2-[(6-methoxypyridin-3-yl)-phenyl-methoxy]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(6-methoxypyridin-3-yl)-phenyl-methoxy]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-[(6-methoxy-3-pyridyl)-phenyl-methoxy]ethanone CAS Name: 2-[(6-methoxy-3-pyridinyl)-phenylmethoxy]-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-[(6-methoxypyridin-3-yl)-phenylmethoxy]ethanone Traditional Name: 1-(4-benzylpiperazino)-2-[(6-methoxy-3-pyridyl)-phenyl-methoxy]ethanone Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)C(C2=CC=CC=C2)OCC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=NC=C(C=C1)C(C2=CC=CC=C2)OCC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3/c1-31-24-13-12-23(18-27-24)26(22-10-6-3-7-11-22)32-20-25(30)29-16-14-28(15-17-29)19-21-8-4-2-5-9-21/h2-13,18,26H,14-17,19-20H2,1H3