2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]-1-[(2S)-2-methylpiperidin-1-yl]ethanone

Systemtic Name: 2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]-1-[(2S)-2-methylpiperidin-1-yl]ethanone Openeye Name: 2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]-1-[(2S)-2-methyl-1-piperidyl]ethanone CAS Name: 2-[2-(4-methoxyphenyl)-4-nitrophenoxy]-1-[(2S)-2-methyl-1-piperidinyl]ethanone IUPAC Name: 2-[2-(4-methoxyphenyl)-4-nitrophenoxy]-1-[(2S)-2-methylpiperidin-1-yl]ethanone Traditional Name: 2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]-1-[(2S)-2-methylpiperidino]ethanone Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@H]1CCCCN1C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24N2O5/c1-15-5-3-4-12-22(15)21(24)14-28-20-11-8-17(23(25)26)13-19(20)16-6-9-18(27-2)10-7-16/h6-11,13,15H,3-5,12,14H2,1-2H3/t15-/m0/s1