1-[4-[3-[[(3-chloranyl-4-ethoxy-phenyl)methylamino]methyl]pyridin-2-yl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[3-[[(3-chloranyl-4-ethoxy-phenyl)methylamino]methyl]pyridin-2-yl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[3-[[(3-chloro-4-ethoxy-phenyl)methylamino]methyl]-2-pyridyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[3-[[(3-chloro-4-ethoxyphenyl)methylamino]methyl]-2-pyridinyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[3-[[(3-chloro-4-ethoxyphenyl)methylamino]methyl]pyridin-2-yl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[3-[[(3-chloro-4-ethoxy-benzyl)amino]methyl]-2-pyridyl]piperazino]ethanone Formula: C21H27ClN4O2 MolecularWeight: 402.91768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNCC2=C(N=CC=C2)N3CCN(CC3)C(=O)C)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNCC2=C(N=CC=C2)N3CCN(CC3)C(=O)C)Cl

InChI

InChI=1S/C21H27ClN4O2/c1-3-28-20-7-6-17(13-19(20)22)14-23-15-18-5-4-8-24-21(18)26-11-9-25(10-12-26)16(2)27/h4-8,13,23H,3,9-12,14-15H2,1-2H3