N-[(2S)-1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[(2S)-1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[(1S)-2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-1-methyl-2-oxo-ethyl]-2-phenoxy-acetamide CAS Name: N-[(2S)-1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-1-oxopropan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[(2S)-1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-1-oxopropan-2-yl]-2-phenoxyacetamide Traditional Name: N-[(1S)-2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-2-keto-1-methyl-ethyl]-2-phenoxy-acetamide Formula: C24H28N2O5 MolecularWeight: 424.48952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C2=CC3=C(C=C2)OCCCO3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)N1CCCC1C2=CC3=C(C=C2)OCCCO3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C24H28N2O5/c1-17(25-23(27)16-31-19-7-3-2-4-8-19)24(28)26-12-5-9-20(26)18-10-11-21-22(15-18)30-14-6-13-29-21/h2-4,7-8,10-11,15,17,20H,5-6,9,12-14,16H2,1H3,(H,25,27)/t17-,20?/m0/s1