(phenylmethyl) N-[3-fluoranyl-4-[4-(2-methoxyethyl)-3-oxidanylidene-piperazin-1-yl]phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[3-fluoranyl-4-[4-(2-methoxyethyl)-3-oxidanylidene-piperazin-1-yl]phenyl]carbamate Openeye Name: benzyl N-[3-fluoro-4-[4-(2-methoxyethyl)-3-oxo-piperazin-1-yl]phenyl]carbamate CAS Name: N-[3-fluoro-4-[4-(2-methoxyethyl)-3-oxo-1-piperazinyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-fluoro-4-[4-(2-methoxyethyl)-3-oxopiperazin-1-yl]phenyl]carbamate Traditional Name: N-[3-fluoro-4-[3-keto-4-(2-methoxyethyl)piperazino]phenyl]carbamic acid benzyl ester Formula: C21H24FN3O4 MolecularWeight: 401.431363

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1CCN(CC1=O)C2=C(C=C(C=C2)NC(=O)OCC3=CC=CC=C3)F

Isomeric SMILES

COCCN1CCN(CC1=O)C2=C(C=C(C=C2)NC(=O)OCC3=CC=CC=C3)F

InChI

InChI=1S/C21H24FN3O4/c1-28-12-11-24-9-10-25(14-20(24)26)19-8-7-17(13-18(19)22)23-21(27)29-15-16-5-3-2-4-6-16/h2-8,13H,9-12,14-15H2,1H3,(H,23,27)