ethyl 4-[(E)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(E)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(E)-3-(3-fluoro-4-methoxy-phenyl)prop-2-enoyl]piperazine-1-carboxylate CAS Name: 4-[(E)-3-(3-fluoro-4-methoxyphenyl)-1-oxoprop-2-enyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-3-(3-fluoro-4-methoxyphenyl)prop-2-enoyl]piperazine-1-carboxylate Traditional Name: 4-[(E)-3-(3-fluoro-4-methoxy-phenyl)acryloyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H21FN2O4 MolecularWeight: 336.358043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C=CC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)/C=C/C2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C17H21FN2O4/c1-3-24-17(22)20-10-8-19(9-11-20)16(21)7-5-13-4-6-15(23-2)14(18)12-13/h4-7,12H,3,8-11H2,1-2H3/b7-5+