(E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(2S)-2-phenylpyrrolidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(2S)-2-phenylpyrrolidin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(2S)-2-phenylpyrrolidin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(2S)-2-phenyl-1-pyrrolidinyl]-2-propen-1-one IUPAC Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(2S)-2-phenylpyrrolidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(2S)-2-phenylpyrrolidino]prop-2-en-1-one Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C=CC2=CC3=C(C=C2)OCCCO3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)/C=C/C2=CC3=C(C=C2)OCCCO3)C4=CC=CC=C4

InChI

InChI=1S/C22H23NO3/c24-22(23-13-4-8-19(23)18-6-2-1-3-7-18)12-10-17-9-11-20-21(16-17)26-15-5-14-25-20/h1-3,6-7,9-12,16,19H,4-5,8,13-15H2/b12-10+/t19-/m0/s1