(5-bromanylpyridin-3-yl)-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methanone

Systemtic Name: (5-bromanylpyridin-3-yl)-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methanone Openeye Name: (5-bromo-3-pyridyl)-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methanone CAS Name: (5-bromo-3-pyridinyl)-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]methanone IUPAC Name: (5-bromopyridin-3-yl)-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]methanone Traditional Name: (5-bromo-3-pyridyl)-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]methanone Formula: C19H19BrN2O3 MolecularWeight: 403.26976

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC(=CN=C2)Br)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)C2=CC(=CN=C2)Br)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C19H19BrN2O3/c20-15-9-14(11-21-12-15)19(23)22-6-1-3-16(22)13-4-5-17-18(10-13)25-8-2-7-24-17/h4-5,9-12,16H,1-3,6-8H2/t16-/m1/s1