methyl 2-[[2-[1-(4-nitrophenyl)piperidin-4-yl]-2-phenyl-ethanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[2-[1-(4-nitrophenyl)piperidin-4-yl]-2-phenyl-ethanoyl]amino]ethanoate Openeye Name: methyl 2-[[2-[1-(4-nitrophenyl)-4-piperidyl]-2-phenyl-acetyl]amino]acetate CAS Name: 2-[[2-[1-(4-nitrophenyl)-4-piperidinyl]-1-oxo-2-phenylethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[1-(4-nitrophenyl)piperidin-4-yl]-2-phenylacetyl]amino]acetate Traditional Name: 2-[[2-[1-(4-nitrophenyl)-4-piperidyl]-2-phenyl-acetyl]amino]acetic acid methyl ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C(C1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

COC(=O)CNC(=O)C(C1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

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