N-[(3S)-1-[3-(3-fluorophenyl)pyrrolidin-1-yl]carbonylpiperidin-3-yl]-4-oxidanyl-adamantane-1-carboxamide

Systemtic Name: N-[(3S)-1-[3-(3-fluorophenyl)pyrrolidin-1-yl]carbonylpiperidin-3-yl]-4-oxidanyl-adamantane-1-carboxamide Openeye Name: N-[(3S)-1-[3-(3-fluorophenyl)pyrrolidine-1-carbonyl]-3-piperidyl]-4-hydroxy-adamantane-1-carboxamide CAS Name: N-[(3S)-1-[[3-(3-fluorophenyl)-1-pyrrolidinyl]-oxomethyl]-3-piperidinyl]-4-hydroxy-1-adamantanecarboxamide IUPAC Name: N-[(3S)-1-[3-(3-fluorophenyl)pyrrolidine-1-carbonyl]piperidin-3-yl]-4-hydroxyadamantane-1-carboxamide Traditional Name: N-[(3S)-1-[3-(3-fluorophenyl)pyrrolidine-1-carbonyl]-3-piperidyl]-4-hydroxy-adamantane-1-carboxamide Formula: C27H36FN3O3 MolecularWeight: 469.591443

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)N2CCC(C2)C3=CC(=CC=C3)F)NC(=O)C45CC6CC(C4)C(C(C6)C5)O

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)N2CCC(C2)C3=CC(=CC=C3)F)NC(=O)C45CC6CC(C4)C(C(C6)C5)O

InChI

InChI=1S/C27H36FN3O3/c28-22-4-1-3-18(11-22)19-6-8-31(15-19)26(34)30-7-2-5-23(16-30)29-25(33)27-12-17-9-20(13-27)24(32)21(10-17)14-27/h1,3-4,11,17,19-21,23-24,32H,2,5-10,12-16H2,(H,29,33)/t17?,19?,20?,21?,23-,24?,27?/m0/s1