[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(7-chloranyl-1,3-benzodioxol-5-yl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(7-chloranyl-1,3-benzodioxol-5-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(7-chloro-1,3-benzodioxol-5-yl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(7-chloro-1,3-benzodioxol-5-yl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(7-chloro-1,3-benzodioxol-5-yl)methanone Traditional Name: (7-chloro-1,3-benzodioxol-5-yl)-(4-piperonylpiperazino)methanone Formula: C20H19ClN2O5 MolecularWeight: 402.82826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=C(C(=C4)Cl)OCO5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=C(C(=C4)Cl)OCO5

InChI

InChI=1S/C20H19ClN2O5/c21-15-8-14(9-18-19(15)28-12-27-18)20(24)23-5-3-22(4-6-23)10-13-1-2-16-17(7-13)26-11-25-16/h1-2,7-9H,3-6,10-12H2