(phenylmethyl) 2-(2-diethylaminoethyloxy)-4-nitro-benzoate

Systemtic Name: (phenylmethyl) 2-(2-diethylaminoethyloxy)-4-nitro-benzoate Openeye Name: benzyl 2-(2-diethylaminoethyloxy)-4-nitro-benzoate CAS Name: 2-(2-diethylaminoethyloxy)-4-nitrobenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(2-diethylaminoethyloxy)-4-nitrobenzoate Traditional Name: 2-(2-diethylaminoethyloxy)-4-nitro-benzoic acid benzyl ester Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCN(CC)CCOC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H24N2O5/c1-3-21(4-2)12-13-26-19-14-17(22(24)25)10-11-18(19)20(23)27-15-16-8-6-5-7-9-16/h5-11,14H,3-4,12-13,15H2,1-2H3