N-[(3S)-2-oxidanylideneazepan-3-yl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[(3S)-2-oxidanylideneazepan-3-yl]-4-(trifluoromethyl)benzamide Openeye Name: N-[(3S)-2-oxoazepan-3-yl]-4-(trifluoromethyl)benzamide CAS Name: N-[(3S)-2-oxo-3-azepanyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[(3S)-2-oxoazepan-3-yl]-4-(trifluoromethyl)benzamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-4-(trifluoromethyl)benzamide Formula: C14H15F3N2O2 MolecularWeight: 300.27631

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1CCNC(=O)[C@H](C1)NC(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C14H15F3N2O2/c15-14(16,17)10-6-4-9(5-7-10)12(20)19-11-3-1-2-8-18-13(11)21/h4-7,11H,1-3,8H2,(H,18,21)(H,19,20)/t11-/m0/s1