4,5-dimethoxy-2-nitro-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4,5-dimethoxy-2-nitro-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4,5-dimethoxy-2-nitro-N-[[4-(1-piperidylmethyl)phenyl]methyl]benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-[[4-(1-piperidinylmethyl)phenyl]methyl]benzamide IUPAC Name: 4,5-dimethoxy-2-nitro-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4,5-dimethoxy-2-nitro-N-[4-(piperidinomethyl)benzyl]benzamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NCC2=CC=C(C=C2)CN3CCCCC3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NCC2=CC=C(C=C2)CN3CCCCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H27N3O5/c1-29-20-12-18(19(25(27)28)13-21(20)30-2)22(26)23-14-16-6-8-17(9-7-16)15-24-10-4-3-5-11-24/h6-9,12-13H,3-5,10-11,14-15H2,1-2H3,(H,23,26)