2-[2-ethoxy-4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenoxy]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[2-ethoxy-4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenoxy]-1-piperidin-1-yl-ethanone Openeye Name: 2-[2-ethoxy-4-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]phenoxy]-1-(1-piperidyl)ethanone CAS Name: 2-[2-ethoxy-4-[(E)-2-(3-methyl-4-nitro-5-isoxazolyl)ethenyl]phenoxy]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[2-ethoxy-4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenoxy]-1-piperidin-1-ylethanone Traditional Name: 2-[2-ethoxy-4-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]phenoxy]-1-piperidino-ethanone Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC2=C(C(=NO2)C)[N+](=O)[O-])OCC(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C2=C(C(=NO2)C)[N+](=O)[O-])OCC(=O)N3CCCCC3

InChI

InChI=1S/C21H25N3O6/c1-3-28-19-13-16(8-10-18-21(24(26)27)15(2)22-30-18)7-9-17(19)29-14-20(25)23-11-5-4-6-12-23/h7-10,13H,3-6,11-12,14H2,1-2H3/b10-8+