ethyl 3-[[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[2-(3,4-diethoxyanilino)-2-oxo-ethyl]-methyl-carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[2-(3,4-diethoxyanilino)-2-oxoethyl]-methylamino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(3,4-diethoxyanilino)-2-oxoethyl]-methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[[2-(3,4-diethoxyanilino)-2-keto-ethyl]-methyl-carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C23H27N3O8 MolecularWeight: 473.47578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O8/c1-5-32-19-9-8-17(13-20(19)33-6-2)24-21(27)14-25(4)22(28)15-10-16(23(29)34-7-3)12-18(11-15)26(30)31/h8-13H,5-7,14H2,1-4H3,(H,24,27)