(3-chloranyl-4-ethoxy-5-methoxy-phenyl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-4-ethoxy-5-methoxy-phenyl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Openeye Name: (3-chloro-4-ethoxy-5-methoxy-phenyl)-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methanone CAS Name: (3-chloro-4-ethoxy-5-methoxyphenyl)-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methanone IUPAC Name: (3-chloro-4-ethoxy-5-methoxyphenyl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Traditional Name: (3-chloro-4-ethoxy-5-methoxy-phenyl)-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]methanone Formula: C20H21ClF3N3O3 MolecularWeight: 443.84725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F)OC

InChI

InChI=1S/C20H21ClF3N3O3/c1-3-30-18-15(21)10-13(11-16(18)29-2)19(28)27-8-6-26(7-9-27)17-5-4-14(12-25-17)20(22,23)24/h4-5,10-12H,3,6-9H2,1-2H3