methyl 2-[1-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(E)-3-(4-fluorophenyl)-1-oxoprop-2-enyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[(E)-3-(4-fluorophenyl)acryloyl]-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C16H17FN2O4 MolecularWeight: 320.315583

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCCN1C(=O)C=CC2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)CC1C(=O)NCCN1C(=O)/C=C/C2=CC=C(C=C2)F

InChI

InChI=1S/C16H17FN2O4/c1-23-15(21)10-13-16(22)18-8-9-19(13)14(20)7-4-11-2-5-12(17)6-3-11/h2-7,13H,8-10H2,1H3,(H,18,22)/b7-4+