[4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-yl]-(5-nitrofuran-2-yl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-yl]-(5-nitrofuran-2-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperidyl]-(5-nitro-2-furyl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperidinyl]-(5-nitro-2-furanyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-yl]-(5-nitrofuran-2-yl)methanone Traditional Name: (5-nitro-2-furyl)-(4-piperonylpiperidino)methanone Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O6/c21-18(15-3-4-17(26-15)20(22)23)19-7-5-12(6-8-19)9-13-1-2-14-16(10-13)25-11-24-14/h1-4,10,12H,5-9,11H2