2-[4-(3-azanylpyrrolidin-1-yl)cyclohexyl]-5-fluoranyl-benzoic acid

Systemtic Name: 2-[4-(3-azanylpyrrolidin-1-yl)cyclohexyl]-5-fluoranyl-benzoic acid Openeye Name: 2-[4-(3-aminopyrrolidin-1-yl)cyclohexyl]-5-fluoro-benzoic acid CAS Name: 2-[4-(3-amino-1-pyrrolidinyl)cyclohexyl]-5-fluorobenzoic acid IUPAC Name: 2-[4-(3-aminopyrrolidin-1-yl)cyclohexyl]-5-fluorobenzoic acid Traditional Name: 2-[4-(3-aminopyrrolidino)cyclohexyl]-5-fluoro-benzoic acid Formula: C17H23FN2O2 MolecularWeight: 306.375123

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=C(C=C(C=C2)F)C(=O)O)N3CCC(C3)N

Isomeric SMILES

C1CC(CCC1C2=C(C=C(C=C2)F)C(=O)O)N3CCC(C3)N

InChI

InChI=1S/C17H23FN2O2/c18-12-3-6-15(16(9-12)17(21)22)11-1-4-14(5-2-11)20-8-7-13(19)10-20/h3,6,9,11,13-14H,1-2,4-5,7-8,10,19H2,(H,21,22)