tert-butyl 3-[(2-methoxyethylamino)methyl]-4-nitro-benzoate

Systemtic Name: tert-butyl 3-[(2-methoxyethylamino)methyl]-4-nitro-benzoate Openeye Name: tert-butyl 3-[(2-methoxyethylamino)methyl]-4-nitro-benzoate CAS Name: 3-[(2-methoxyethylamino)methyl]-4-nitrobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(2-methoxyethylamino)methyl]-4-nitrobenzoate Traditional Name: 3-[(2-methoxyethylamino)methyl]-4-nitro-benzoic acid tert-butyl ester Formula: C15H22N2O5 MolecularWeight: 310.34558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])CNCCOC

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])CNCCOC

InChI

InChI=1S/C15H22N2O5/c1-15(2,3)22-14(18)11-5-6-13(17(19)20)12(9-11)10-16-7-8-21-4/h5-6,9,16H,7-8,10H2,1-4H3