2,5-dimethyl-4-(4-methylpiperazin-1-yl)sulfonyl-furan-3-carboxylic acid

Systemtic Name: 2,5-dimethyl-4-(4-methylpiperazin-1-yl)sulfonyl-furan-3-carboxylic acid Openeye Name: 2,5-dimethyl-4-(4-methylpiperazin-1-yl)sulfonyl-furan-3-carboxylic acid CAS Name: 2,5-dimethyl-4-[(4-methyl-1-piperazinyl)sulfonyl]-3-furancarboxylic acid IUPAC Name: 2,5-dimethyl-4-(4-methylpiperazin-1-yl)sulfonylfuran-3-carboxylic acid Traditional Name: 2,5-dimethyl-4-(4-methylpiperazino)sulfonyl-3-furoic acid Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)C)S(=O)(=O)N2CCN(CC2)C)C(=O)O

Isomeric SMILES

CC1=C(C(=C(O1)C)S(=O)(=O)N2CCN(CC2)C)C(=O)O

InChI

InChI=1S/C12H18N2O5S/c1-8-10(12(15)16)11(9(2)19-8)20(17,18)14-6-4-13(3)5-7-14/h4-7H2,1-3H3,(H,15,16)