2-[(3R)-2,5-bis(oxidanylidene)-1-(3-propan-2-yloxypropyl)pyrrolidin-3-yl]sulfanylbenzoic acid

Systemtic Name: 2-[(3R)-2,5-bis(oxidanylidene)-1-(3-propan-2-yloxypropyl)pyrrolidin-3-yl]sulfanylbenzoic acid Openeye Name: 2-[(3R)-1-(3-isopropoxypropyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanylbenzoic acid CAS Name: 2-[[(3R)-2,5-dioxo-1-(3-propan-2-yloxypropyl)-3-pyrrolidinyl]thio]benzoic acid IUPAC Name: 2-[(3R)-2,5-dioxo-1-(3-propan-2-yloxypropyl)pyrrolidin-3-yl]sulfanylbenzoic acid Traditional Name: 2-[[(3R)-1-(3-isopropoxypropyl)-2,5-diketo-pyrrolidin-3-yl]thio]benzoic acid Formula: C17H21NO5S MolecularWeight: 351.41734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)CC(C1=O)SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C)OCCCN1C(=O)C[C@H](C1=O)SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C17H21NO5S/c1-11(2)23-9-5-8-18-15(19)10-14(16(18)20)24-13-7-4-3-6-12(13)17(21)22/h3-4,6-7,11,14H,5,8-10H2,1-2H3,(H,21,22)/t14-/m1/s1