[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl] (E)-3-(5-bromanylfuran-2-yl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl] (E)-3-(5-bromanylfuran-2-yl)prop-2-enoate Openeye Name: [2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl] (E)-3-(5-bromo-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-furanyl)-2-propenoic acid [2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-(4-benzylpiperazin-1-yl)-2-oxoethyl] (E)-3-(5-bromofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-furyl)acrylic acid [2-(4-benzylpiperazino)-2-keto-ethyl] ester Formula: C20H21BrN2O4 MolecularWeight: 433.29574

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)COC(=O)C=CC3=CC=C(O3)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)COC(=O)/C=C/C3=CC=C(O3)Br

InChI

InChI=1S/C20H21BrN2O4/c21-18-8-6-17(27-18)7-9-20(25)26-15-19(24)23-12-10-22(11-13-23)14-16-4-2-1-3-5-16/h1-9H,10-15H2/b9-7+