(phenylmethyl) 2-(2-methoxyethylamino)-5-nitro-benzoate

Systemtic Name: (phenylmethyl) 2-(2-methoxyethylamino)-5-nitro-benzoate Openeye Name: benzyl 2-(2-methoxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-methoxyethylamino)-5-nitrobenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(2-methoxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-methoxyethylamino)-5-nitro-benzoic acid benzyl ester Formula: C17H18N2O5 MolecularWeight: 330.33522

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC=CC=C2

Isomeric SMILES

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H18N2O5/c1-23-10-9-18-16-8-7-14(19(21)22)11-15(16)17(20)24-12-13-5-3-2-4-6-13/h2-8,11,18H,9-10,12H2,1H3