methyl 4-[[4-(furan-2-ylmethyl)piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[4-(furan-2-ylmethyl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[4-(2-furylmethyl)piperazine-1-carbonyl]amino]benzoate CAS Name: 4-[[[4-(2-furanylmethyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(furan-2-ylmethyl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 4-[[4-(2-furfuryl)piperazine-1-carbonyl]amino]benzoic acid methyl ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)CC3=CC=CO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)CC3=CC=CO3

InChI

InChI=1S/C18H21N3O4/c1-24-17(22)14-4-6-15(7-5-14)19-18(23)21-10-8-20(9-11-21)13-16-3-2-12-25-16/h2-7,12H,8-11,13H2,1H3,(H,19,23)