1-[2-[[1-(4-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-3-methyl-pentanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[[1-(4-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-3-methyl-pentanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[[1-(4-fluorophenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]-3-methyl-pentanoyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[[[1-(4-fluorophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]-3-methyl-1-oxopentyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[[1-(4-fluorophenyl)-5-oxopyrrolidine-3-carbonyl]amino]-3-methylpentanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[[1-(4-fluorophenyl)-5-keto-pyrrolidine-3-carbonyl]amino]-3-methyl-pentanoyl]isonipecotic acid Formula: C23H30FN3O5 MolecularWeight: 447.499803

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCC(CC1)C(=O)O)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(C)C(C(=O)N1CCC(CC1)C(=O)O)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H30FN3O5/c1-3-14(2)20(22(30)26-10-8-15(9-11-26)23(31)32)25-21(29)16-12-19(28)27(13-16)18-6-4-17(24)5-7-18/h4-7,14-16,20H,3,8-13H2,1-2H3,(H,25,29)(H,31,32)