[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-chloranylpyridin-3-yl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-chloranylpyridin-3-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-chloro-3-pyridyl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(2-chloro-3-pyridinyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-chloropyridin-3-yl)methanone Traditional Name: (2-chloro-3-pyridyl)-(4-piperonylpiperazino)methanone Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=C(N=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=C(N=CC=C4)Cl

InChI

InChI=1S/C18H18ClN3O3/c19-17-14(2-1-5-20-17)18(23)22-8-6-21(7-9-22)11-13-3-4-15-16(10-13)25-12-24-15/h1-5,10H,6-9,11-12H2