(E)-1-(2-chloranyl-3,4-dimethoxy-phenyl)-3-(4-pyridin-4-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(2-chloranyl-3,4-dimethoxy-phenyl)-3-(4-pyridin-4-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(2-chloro-3,4-dimethoxy-phenyl)-3-[4-(4-pyridyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-1-(2-chloro-3,4-dimethoxyphenyl)-3-(4-pyridin-4-yl-1-piperazinyl)-2-propen-1-one IUPAC Name: (E)-1-(2-chloro-3,4-dimethoxyphenyl)-3-(4-pyridin-4-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-1-(2-chloro-3,4-dimethoxy-phenyl)-3-[4-(4-pyridyl)piperazino]prop-2-en-1-one Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)C=CN2CCN(CC2)C3=CC=NC=C3)Cl)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)/C=C/N2CCN(CC2)C3=CC=NC=C3)Cl)OC

InChI

InChI=1S/C20H22ClN3O3/c1-26-18-4-3-16(19(21)20(18)27-2)17(25)7-10-23-11-13-24(14-12-23)15-5-8-22-9-6-15/h3-10H,11-14H2,1-2H3/b10-7+