N-(3,4-dimethoxyphenyl)-2-[4-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[4-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[4-[2-(2-fluoroanilino)-2-oxo-ethyl]piperazin-1-yl]acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[4-[2-(2-fluoroanilino)-2-oxoethyl]-1-piperazinyl]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[4-[2-(2-fluoroanilino)-2-oxoethyl]piperazin-1-yl]acetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[4-[2-(2-fluoroanilino)-2-keto-ethyl]piperazino]acetamide Formula: C22H27FN4O4 MolecularWeight: 430.472583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC(=O)NC3=CC=CC=C3F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC(=O)NC3=CC=CC=C3F)OC

InChI

InChI=1S/C22H27FN4O4/c1-30-19-8-7-16(13-20(19)31-2)24-21(28)14-26-9-11-27(12-10-26)15-22(29)25-18-6-4-3-5-17(18)23/h3-8,13H,9-12,14-15H2,1-2H3,(H,24,28)(H,25,29)