1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(4-pyrazol-1-ylphenyl)ethanone

Systemtic Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(4-pyrazol-1-ylphenyl)ethanone Openeye Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(4-pyrazol-1-ylphenyl)ethanone CAS Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-2-[4-(1-pyrazolyl)phenyl]ethanone IUPAC Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(4-pyrazol-1-ylphenyl)ethanone Traditional Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]-2-(4-pyrazol-1-ylphenyl)ethanone Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC2=CC=C(C=C2)N3C=CC=N3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CC(N(C1)C(=O)CC2=CC=C(C=C2)N3C=CC=N3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C23H23N3O3/c27-23(15-17-4-7-19(8-5-17)26-12-2-10-24-26)25-11-1-3-20(25)18-6-9-21-22(16-18)29-14-13-28-21/h2,4-10,12,16,20H,1,3,11,13-15H2