6-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanyl-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 6-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanyl-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 6-(2,5-dioxo-1-phenyl-pyrrolidin-3-yl)sulfanyl-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 6-[(2,5-dioxo-1-phenyl-3-pyrrolidinyl)thio]-6-methyl-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 6-(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl-6-methylcyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 6-[(2,5-diketo-1-phenyl-pyrrolidin-3-yl)thio]-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC=CC1C(=O)O)SC2CC(=O)N(C2=O)C3=CC=CC=C3

Isomeric SMILES

CC1(C=CC=CC1C(=O)O)SC2CC(=O)N(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17NO4S/c1-18(10-6-5-9-13(18)17(22)23)24-14-11-15(20)19(16(14)21)12-7-3-2-4-8-12/h2-10,13-14H,11H2,1H3,(H,22,23)