(5S,6R,7R)-6-oxidanyl-7-phenethyl-5-propan-2-yl-azepan-2-one

Systemtic Name: (5S,6R,7R)-6-oxidanyl-7-phenethyl-5-propan-2-yl-azepan-2-one Openeye Name: (5S,6R,7R)-6-hydroxy-5-isopropyl-7-phenethyl-azepan-2-one CAS Name: (5S,6R,7R)-6-hydroxy-7-phenethyl-5-propan-2-yl-2-azepanone IUPAC Name: (5S,6R,7R)-6-hydroxy-7-phenethyl-5-propan-2-ylazepan-2-one Traditional Name: (5S,6R,7R)-6-hydroxy-5-isopropyl-7-phenethyl-azepan-2-one Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC(=O)NC(C1O)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H]1CCC(=O)N[C@@H]([C@@H]1O)CCC2=CC=CC=C2

InChI

InChI=1S/C17H25NO2/c1-12(2)14-9-11-16(19)18-15(17(14)20)10-8-13-6-4-3-5-7-13/h3-7,12,14-15,17,20H,8-11H2,1-2H3,(H,18,19)/t14-,15+,17+/m0/s1