ethanedioic acid; 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-(4-methylphenyl)propanamide

Systemtic Name: ethanedioic acid; 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-(4-methylphenyl)propanamide Openeye Name: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-(p-tolyl)propanamide; oxalic acid CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-N-(4-methylphenyl)propanamide; oxalic acid IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-(4-methylphenyl)propanamide; oxalic acid Traditional Name: 2-[4-(2-furoyl)piperazino]-N-(p-tolyl)propionamide; oxalic acid Formula: C21H25N3O7 MolecularWeight: 431.4391

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O3.C2H2O4/c1-14-5-7-16(8-6-14)20-18(23)15(2)21-9-11-22(12-10-21)19(24)17-4-3-13-25-17;3-1(4)2(5)6/h3-8,13,15H,9-12H2,1-2H3,(H,20,23);(H,3,4)(H,5,6)