1-(4-butoxyphenyl)-2-[4-(3-chloranylpyridin-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 1-(4-butoxyphenyl)-2-[4-(3-chloranylpyridin-2-yl)piperazin-1-yl]ethanone Openeye Name: 1-(4-butoxyphenyl)-2-[4-(3-chloro-2-pyridyl)piperazin-1-yl]ethanone CAS Name: 1-(4-butoxyphenyl)-2-[4-(3-chloro-2-pyridinyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-butoxyphenyl)-2-[4-(3-chloropyridin-2-yl)piperazin-1-yl]ethanone Traditional Name: 1-(4-butoxyphenyl)-2-[4-(3-chloro-2-pyridyl)piperazino]ethanone Formula: C21H26ClN3O2 MolecularWeight: 387.90304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)CN2CCN(CC2)C3=C(C=CC=N3)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)CN2CCN(CC2)C3=C(C=CC=N3)Cl

InChI

InChI=1S/C21H26ClN3O2/c1-2-3-15-27-18-8-6-17(7-9-18)20(26)16-24-11-13-25(14-12-24)21-19(22)5-4-10-23-21/h4-10H,2-3,11-16H2,1H3