2-(azepan-3-yl)-N-[3,5-bis(trifluoromethyl)phenyl]azetidine-1-carboxamide

Systemtic Name: 2-(azepan-3-yl)-N-[3,5-bis(trifluoromethyl)phenyl]azetidine-1-carboxamide Openeye Name: 2-(azepan-3-yl)-N-[3,5-bis(trifluoromethyl)phenyl]azetidine-1-carboxamide CAS Name: 2-(3-azepanyl)-N-[3,5-bis(trifluoromethyl)phenyl]-1-azetidinecarboxamide IUPAC Name: 2-(azepan-3-yl)-N-[3,5-bis(trifluoromethyl)phenyl]azetidine-1-carboxamide Traditional Name: 2-(azepan-3-yl)-N-[3,5-bis(trifluoromethyl)phenyl]azetidine-1-carboxamide Formula: C18H21F6N3O MolecularWeight: 409.369259

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNCC(C1)C2CCN2C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CCNCC(C1)C2CCN2C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H21F6N3O/c19-17(20,21)12-7-13(18(22,23)24)9-14(8-12)26-16(28)27-6-4-15(27)11-3-1-2-5-25-10-11/h7-9,11,15,25H,1-6,10H2,(H,26,28)