4-[1-cyclopropyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylbenzoic acid

Systemtic Name: 4-[1-cyclopropyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylbenzoic acid Openeye Name: 4-(1-cyclopropyl-2,5-dioxo-pyrrolidin-3-yl)sulfanylbenzoic acid CAS Name: 4-[(1-cyclopropyl-2,5-dioxo-3-pyrrolidinyl)thio]benzoic acid IUPAC Name: 4-(1-cyclopropyl-2,5-dioxopyrrolidin-3-yl)sulfanylbenzoic acid Traditional Name: 4-[(1-cyclopropyl-2,5-diketo-pyrrolidin-3-yl)thio]benzoic acid Formula: C14H13NO4S MolecularWeight: 291.32232

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)CC(C2=O)SC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CC1N2C(=O)CC(C2=O)SC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C14H13NO4S/c16-12-7-11(13(17)15(12)9-3-4-9)20-10-5-1-8(2-6-10)14(18)19/h1-2,5-6,9,11H,3-4,7H2,(H,18,19)