5-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanylmethyl]-3-methyl-furan-2-carboxylic acid

Systemtic Name: 5-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanylmethyl]-3-methyl-furan-2-carboxylic acid Openeye Name: 5-[2-(1,3-dioxoisoindolin-2-yl)ethylsulfanylmethyl]-3-methyl-furan-2-carboxylic acid CAS Name: 5-[[2-(1,3-dioxo-2-isoindolyl)ethylthio]methyl]-3-methyl-2-furancarboxylic acid IUPAC Name: 5-[2-(1,3-dioxoisoindol-2-yl)ethylsulfanylmethyl]-3-methylfuran-2-carboxylic acid Traditional Name: 3-methyl-5-[(2-phthalimidoethylthio)methyl]-2-furoic acid Formula: C17H15NO5S MolecularWeight: 345.3697

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CSCCN2C(=O)C3=CC=CC=C3C2=O)C(=O)O

Isomeric SMILES

CC1=C(OC(=C1)CSCCN2C(=O)C3=CC=CC=C3C2=O)C(=O)O

InChI

InChI=1S/C17H15NO5S/c1-10-8-11(23-14(10)17(21)22)9-24-7-6-18-15(19)12-4-2-3-5-13(12)16(18)20/h2-5,8H,6-7,9H2,1H3,(H,21,22)