2-[[1-[1-(4-chlorophenyl)cyclopropyl]carbonyl-3-oxidanyl-pyrrolidin-3-yl]methyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[[1-[1-(4-chlorophenyl)cyclopropyl]carbonyl-3-oxidanyl-pyrrolidin-3-yl]methyl]pyridine-3-carboxylic acid Openeye Name: 2-[[1-[1-(4-chlorophenyl)cyclopropanecarbonyl]-3-hydroxy-pyrrolidin-3-yl]methyl]pyridine-3-carboxylic acid CAS Name: 2-[[1-[[1-(4-chlorophenyl)cyclopropyl]-oxomethyl]-3-hydroxy-3-pyrrolidinyl]methyl]-3-pyridinecarboxylic acid IUPAC Name: 2-[[1-[1-(4-chlorophenyl)cyclopropanecarbonyl]-3-hydroxypyrrolidin-3-yl]methyl]pyridine-3-carboxylic acid Traditional Name: 2-[[1-[1-(4-chlorophenyl)cyclopropanecarbonyl]-3-hydroxy-pyrrolidin-3-yl]methyl]nicotinic acid Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C2=CC=C(C=C2)Cl)C(=O)N3CCC(C3)(CC4=C(C=CC=N4)C(=O)O)O

Isomeric SMILES

C1CC1(C2=CC=C(C=C2)Cl)C(=O)N3CCC(C3)(CC4=C(C=CC=N4)C(=O)O)O

InChI

InChI=1S/C21H21ClN2O4/c22-15-5-3-14(4-6-15)21(7-8-21)19(27)24-11-9-20(28,13-24)12-17-16(18(25)26)2-1-10-23-17/h1-6,10,28H,7-9,11-13H2,(H,25,26)