(4,5-dimethoxy-2-nitro-phenyl)-(4-phenethylpiperidin-1-yl)methanone

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)-(4-phenethylpiperidin-1-yl)methanone Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)-(4-phenethyl-1-piperidyl)methanone CAS Name: (4,5-dimethoxy-2-nitrophenyl)-(4-phenethyl-1-piperidinyl)methanone IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)-(4-phenethylpiperidin-1-yl)methanone Traditional Name: (4,5-dimethoxy-2-nitro-phenyl)-(4-phenethylpiperidino)methanone Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)CCC3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)CCC3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H26N2O5/c1-28-20-14-18(19(24(26)27)15-21(20)29-2)22(25)23-12-10-17(11-13-23)9-8-16-6-4-3-5-7-16/h3-7,14-15,17H,8-13H2,1-2H3