[1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl] 4-methylbenzoate

Systemtic Name: [1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl] 4-methylbenzoate Openeye Name: [2-[4-(furan-2-carbonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-1-oxopropan-2-yl] ester IUPAC Name: [1-[4-(furan-2-carbonyl)piperazin-1-yl]-1-oxopropan-2-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-[4-(2-furoyl)piperazino]-2-keto-1-methyl-ethyl] ester Formula: C20H22N2O5 MolecularWeight: 370.39908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC(C)C(=O)N2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC(C)C(=O)N2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C20H22N2O5/c1-14-5-7-16(8-6-14)20(25)27-15(2)18(23)21-9-11-22(12-10-21)19(24)17-4-3-13-26-17/h3-8,13,15H,9-12H2,1-2H3