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

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(3-methyl-4-nitro-phenyl)carbonylpiperidin-4-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(3-methyl-4-nitro-benzoyl)-4-piperidyl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[(3-methyl-4-nitrophenyl)-oxomethyl]-4-piperidinyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(3-methyl-4-nitrobenzoyl)piperidin-4-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(3-methyl-4-nitro-benzoyl)-4-piperidyl]methanone Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N2O6/c1-14-12-17(2-4-18(14)24(27)28)22(26)23-8-6-15(7-9-23)21(25)16-3-5-19-20(13-16)30-11-10-29-19/h2-5,12-13,15H,6-11H2,1H3