4-[1-[4-(2-fluorophenyl)piperazin-1-yl]ethylcarbamoylamino]furan-3-carboxylic acid

Systemtic Name: 4-[1-[4-(2-fluorophenyl)piperazin-1-yl]ethylcarbamoylamino]furan-3-carboxylic acid Openeye Name: 4-[1-[4-(2-fluorophenyl)piperazin-1-yl]ethylcarbamoylamino]furan-3-carboxylic acid CAS Name: 4-[[[1-[4-(2-fluorophenyl)-1-piperazinyl]ethylamino]-oxomethyl]amino]-3-furancarboxylic acid IUPAC Name: 4-[1-[4-(2-fluorophenyl)piperazin-1-yl]ethylcarbamoylamino]furan-3-carboxylic acid Traditional Name: 4-[1-[4-(2-fluorophenyl)piperazino]ethylcarbamoylamino]-3-furoic acid Formula: C18H21FN4O4 MolecularWeight: 376.382143

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=O)NC1=COC=C1C(=O)O)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CC(NC(=O)NC1=COC=C1C(=O)O)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C18H21FN4O4/c1-12(20-18(26)21-15-11-27-10-13(15)17(24)25)22-6-8-23(9-7-22)16-5-3-2-4-14(16)19/h2-5,10-12H,6-9H2,1H3,(H,24,25)(H2,20,21,26)