2-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(3-morpholin-4-ylpropyl)ethanamide

Systemtic Name: 2-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(3-morpholin-4-ylpropyl)ethanamide Openeye Name: 2-[1-[(2-fluoro-4-methoxy-phenyl)methyl]-3-oxo-piperazin-2-yl]-N-(3-morpholinopropyl)acetamide CAS Name: 2-[1-[(2-fluoro-4-methoxyphenyl)methyl]-3-oxo-2-piperazinyl]-N-[3-(4-morpholinyl)propyl]acetamide IUPAC Name: 2-[1-[(2-fluoro-4-methoxyphenyl)methyl]-3-oxopiperazin-2-yl]-N-(3-morpholin-4-ylpropyl)acetamide Traditional Name: 2-[1-(2-fluoro-4-methoxy-benzyl)-3-keto-piperazin-2-yl]-N-(3-morpholinopropyl)acetamide Formula: C21H31FN4O4 MolecularWeight: 422.493643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCNC(=O)C2CC(=O)NCCCN3CCOCC3)F

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCNC(=O)C2CC(=O)NCCCN3CCOCC3)F

InChI

InChI=1S/C21H31FN4O4/c1-29-17-4-3-16(18(22)13-17)15-26-8-6-24-21(28)19(26)14-20(27)23-5-2-7-25-9-11-30-12-10-25/h3-4,13,19H,2,5-12,14-15H2,1H3,(H,23,27)(H,24,28)