5-methyl-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]furan-2-carboxylic acid

Systemtic Name: 5-methyl-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]furan-2-carboxylic acid Openeye Name: 5-methyl-4-[[4-(2-pyridyl)piperazin-1-yl]methyl]furan-2-carboxylic acid CAS Name: 5-methyl-4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-2-furancarboxylic acid IUPAC Name: 5-methyl-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]furan-2-carboxylic acid Traditional Name: 5-methyl-4-[[4-(2-pyridyl)piperazino]methyl]-2-furoic acid Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)O)CN2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC1=C(C=C(O1)C(=O)O)CN2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C16H19N3O3/c1-12-13(10-14(22-12)16(20)21)11-18-6-8-19(9-7-18)15-4-2-3-5-17-15/h2-5,10H,6-9,11H2,1H3,(H,20,21)