N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(4-methyl-1-piperidinyl)-5-nitrobenzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(4-methylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H25N3O5/c1-15-6-8-24(9-7-15)19-4-3-17(25(27)28)13-18(19)22(26)23-14-16-2-5-20-21(12-16)30-11-10-29-20/h2-5,12-13,15H,6-11,14H2,1H3,(H,23,26)