ethyl 3-[1-(3,4-diethoxyphenyl)ethylcarbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[1-(3,4-diethoxyphenyl)ethylcarbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[1-(3,4-diethoxyphenyl)ethylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[1-(3,4-diethoxyphenyl)ethylamino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[1-(3,4-diethoxyphenyl)ethylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[1-(3,4-diethoxyphenyl)ethylcarbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C22H26N2O7 MolecularWeight: 430.45104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC)OCC

InChI

InChI=1S/C22H26N2O7/c1-5-29-19-9-8-15(13-20(19)30-6-2)14(4)23-21(25)16-10-17(22(26)31-7-3)12-18(11-16)24(27)28/h8-14H,5-7H2,1-4H3,(H,23,25)