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

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[(2-methoxy-5-nitro-phenyl)methyl]piperidin-4-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[(2-methoxy-5-nitro-phenyl)methyl]-4-piperidyl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[(2-methoxy-5-nitrophenyl)methyl]-4-piperidinyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[(2-methoxy-5-nitrophenyl)methyl]piperidin-4-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-(2-methoxy-5-nitro-benzyl)-4-piperidyl]methanone Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])CN2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])CN2CCC(CC2)C(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H24N2O6/c1-28-19-5-3-18(24(26)27)12-17(19)14-23-8-6-15(7-9-23)22(25)16-2-4-20-21(13-16)30-11-10-29-20/h2-5,12-13,15H,6-11,14H2,1H3