4-[1-(4-phenylpiperazin-1-yl)ethylcarbamoylamino]furan-3-carboxylic acid

Systemtic Name: 4-[1-(4-phenylpiperazin-1-yl)ethylcarbamoylamino]furan-3-carboxylic acid Openeye Name: 4-[1-(4-phenylpiperazin-1-yl)ethylcarbamoylamino]furan-3-carboxylic acid CAS Name: 4-[[oxo-[1-(4-phenyl-1-piperazinyl)ethylamino]methyl]amino]-3-furancarboxylic acid IUPAC Name: 4-[1-(4-phenylpiperazin-1-yl)ethylcarbamoylamino]furan-3-carboxylic acid Traditional Name: 4-[1-(4-phenylpiperazino)ethylcarbamoylamino]-3-furoic acid Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O4/c1-13(19-18(25)20-16-12-26-11-15(16)17(23)24)21-7-9-22(10-8-21)14-5-3-2-4-6-14/h2-6,11-13H,7-10H2,1H3,(H,23,24)(H2,19,20,25)