5-(4-methyl-2-piperazin-1-ylcarbonyl-phenyl)furan-2-carboxylic acid

Systemtic Name: 5-(4-methyl-2-piperazin-1-ylcarbonyl-phenyl)furan-2-carboxylic acid Openeye Name: 5-[4-methyl-2-(piperazine-1-carbonyl)phenyl]furan-2-carboxylic acid CAS Name: 5-[4-methyl-2-[oxo(1-piperazinyl)methyl]phenyl]-2-furancarboxylic acid IUPAC Name: 5-[4-methyl-2-(piperazine-1-carbonyl)phenyl]furan-2-carboxylic acid Traditional Name: 5-[4-methyl-2-(piperazine-1-carbonyl)phenyl]-2-furoic acid Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=C(O2)C(=O)O)C(=O)N3CCNCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=C(O2)C(=O)O)C(=O)N3CCNCC3

InChI

InChI=1S/C17H18N2O4/c1-11-2-3-12(14-4-5-15(23-14)17(21)22)13(10-11)16(20)19-8-6-18-7-9-19/h2-5,10,18H,6-9H2,1H3,(H,21,22)