(2S)-1-[1-[2-(4-fluoranylphenoxy)ethyl]-7-oxidanylidene-azepan-4-yl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[1-[2-(4-fluoranylphenoxy)ethyl]-7-oxidanylidene-azepan-4-yl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[1-[2-(4-fluorophenoxy)ethyl]-7-oxo-azepan-4-yl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[1-[2-(4-fluorophenoxy)ethyl]-7-oxo-4-azepanyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[1-[2-(4-fluorophenoxy)ethyl]-7-oxoazepan-4-yl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[1-[2-(4-fluorophenoxy)ethyl]-7-keto-azepan-4-yl]pyrrolidine-2-carboxamide Formula: C19H26FN3O3 MolecularWeight: 363.426443

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2CCC(=O)N(CC2)CCOC3=CC=C(C=C3)F)C(=O)N

Isomeric SMILES

C1C[C@H](N(C1)C2CCC(=O)N(CC2)CCOC3=CC=C(C=C3)F)C(=O)N

InChI

InChI=1S/C19H26FN3O3/c20-14-3-6-16(7-4-14)26-13-12-22-11-9-15(5-8-18(22)24)23-10-1-2-17(23)19(21)25/h3-4,6-7,15,17H,1-2,5,8-13H2,(H2,21,25)/t15?,17-/m0/s1