3-(methylamino)-1-(1,2-oxazol-5-ylmethyl)-7-phenyl-azepan-2-one

Systemtic Name: 3-(methylamino)-1-(1,2-oxazol-5-ylmethyl)-7-phenyl-azepan-2-one Openeye Name: 1-(isoxazol-5-ylmethyl)-3-(methylamino)-7-phenyl-azepan-2-one CAS Name: 1-(5-isoxazolylmethyl)-3-(methylamino)-7-phenyl-2-azepanone IUPAC Name: 3-(methylamino)-1-(1,2-oxazol-5-ylmethyl)-7-phenylazepan-2-one Traditional Name: 1-(isoxazol-5-ylmethyl)-3-(methylamino)-7-phenyl-azepan-2-one Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

CNC1CCCC(N(C1=O)CC2=CC=NO2)C3=CC=CC=C3

Isomeric SMILES

CNC1CCCC(N(C1=O)CC2=CC=NO2)C3=CC=CC=C3

InChI

InChI=1S/C17H21N3O2/c1-18-15-8-5-9-16(13-6-3-2-4-7-13)20(17(15)21)12-14-10-11-19-22-14/h2-4,6-7,10-11,15-16,18H,5,8-9,12H2,1H3