ethyl 2-(ethoxycarbonylamino)-3-methyl-4-nitro-6-propan-2-yl-benzoate

Systemtic Name: ethyl 2-(ethoxycarbonylamino)-3-methyl-4-nitro-6-propan-2-yl-benzoate Openeye Name: ethyl 2-(ethoxycarbonylamino)-6-isopropyl-3-methyl-4-nitro-benzoate CAS Name: 2-(ethoxycarbonylamino)-3-methyl-4-nitro-6-propan-2-ylbenzoic acid ethyl ester IUPAC Name: ethyl 2-(ethoxycarbonylamino)-3-methyl-4-nitro-6-propan-2-ylbenzoate Traditional Name: 2-(carbethoxyamino)-6-isopropyl-3-methyl-4-nitro-benzoic acid ethyl ester Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1C(C)C)[N+](=O)[O-])C)NC(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1C(C)C)[N+](=O)[O-])C)NC(=O)OCC

InChI

InChI=1S/C16H22N2O6/c1-6-23-15(19)13-11(9(3)4)8-12(18(21)22)10(5)14(13)17-16(20)24-7-2/h8-9H,6-7H2,1-5H3,(H,17,20)