7-oxidanylidene-N-[(3S)-1-phenylpiperidin-3-yl]azepane-4-carboxamide

Systemtic Name: 7-oxidanylidene-N-[(3S)-1-phenylpiperidin-3-yl]azepane-4-carboxamide Openeye Name: 7-oxo-N-[(3S)-1-phenyl-3-piperidyl]azepane-4-carboxamide CAS Name: 7-oxo-N-[(3S)-1-phenyl-3-piperidinyl]-4-azepanecarboxamide IUPAC Name: 7-oxo-N-[(3S)-1-phenylpiperidin-3-yl]azepane-4-carboxamide Traditional Name: 7-keto-N-[(3S)-1-phenyl-3-piperidyl]azepane-4-carboxamide Formula: C18H25N3O2 MolecularWeight: 315.41

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=CC=C2)NC(=O)C3CCC(=O)NCC3

Isomeric SMILES

C1C[C@@H](CN(C1)C2=CC=CC=C2)NC(=O)C3CCC(=O)NCC3

InChI

InChI=1S/C18H25N3O2/c22-17-9-8-14(10-11-19-17)18(23)20-15-5-4-12-21(13-15)16-6-2-1-3-7-16/h1-3,6-7,14-15H,4-5,8-13H2,(H,19,22)(H,20,23)/t14?,15-/m0/s1