2-(1,3-benzodioxol-5-yl)-1-[2-(2-chloranylpyridin-3-yl)carbonylpyrazolidin-1-yl]ethanone

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2-chloranylpyridin-3-yl)carbonylpyrazolidin-1-yl]ethanone Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2-chloropyridine-3-carbonyl)pyrazolidin-1-yl]ethanone CAS Name: 2-(1,3-benzodioxol-5-yl)-1-[2-[(2-chloro-3-pyridinyl)-oxomethyl]-1-pyrazolidinyl]ethanone IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2-chloropyridine-3-carbonyl)pyrazolidin-1-yl]ethanone Traditional Name: 2-(1,3-benzodioxol-5-yl)-1-[2-(2-chloronicotinoyl)pyrazolidin-1-yl]ethanone Formula: C18H16ClN3O4 MolecularWeight: 373.79034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=O)C2=C(N=CC=C2)Cl)C(=O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(N(C1)C(=O)C2=C(N=CC=C2)Cl)C(=O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H16ClN3O4/c19-17-13(3-1-6-20-17)18(24)22-8-2-7-21(22)16(23)10-12-4-5-14-15(9-12)26-11-25-14/h1,3-6,9H,2,7-8,10-11H2