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

Systemtic Name: methyl 2-[1-(4-nitrophenyl)piperidin-4-yl]-2-phenyl-ethanoate Openeye Name: methyl 2-[1-(4-nitrophenyl)-4-piperidyl]-2-phenyl-acetate CAS Name: 2-[1-(4-nitrophenyl)-4-piperidinyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[1-(4-nitrophenyl)piperidin-4-yl]-2-phenylacetate Traditional Name: 2-[1-(4-nitrophenyl)-4-piperidyl]-2-phenyl-acetic acid methyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4/c1-26-20(23)19(15-5-3-2-4-6-15)16-11-13-21(14-12-16)17-7-9-18(10-8-17)22(24)25/h2-10,16,19H,11-14H2,1H3