2,3-dihydro-1,4-benzodioxin-6-yl-[1-(2-methoxy-5-nitro-phenyl)carbonylpiperidin-4-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(2-methoxy-5-nitro-phenyl)carbonylpiperidin-4-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(2-methoxy-5-nitro-benzoyl)-4-piperidyl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[(2-methoxy-5-nitrophenyl)-oxomethyl]-4-piperidinyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(2-methoxy-5-nitrobenzoyl)piperidin-4-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(2-methoxy-5-nitro-benzoyl)-4-piperidyl]methanone Formula: C22H22N2O7 MolecularWeight: 426.41928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H22N2O7/c1-29-18-5-3-16(24(27)28)13-17(18)22(26)23-8-6-14(7-9-23)21(25)15-2-4-19-20(12-15)31-11-10-30-19/h2-5,12-14H,6-11H2,1H3