ethyl 2,4-dimethyl-5-[(2S)-2-[2-(methylamino)-5-nitro-phenyl]carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(2S)-2-[2-(methylamino)-5-nitro-phenyl]carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(2S)-2-[2-(methylamino)-5-nitro-benzoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[(2S)-2-[[2-(methylamino)-5-nitrophenyl]-oxomethoxy]-1-oxopropyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(2S)-2-[2-(methylamino)-5-nitrobenzoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[(2S)-2-[2-(methylamino)-5-nitro-benzoyl]oxypropanoyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H23N3O7 MolecularWeight: 417.41252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)[C@H](C)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC)C

InChI

InChI=1S/C20H23N3O7/c1-6-29-20(26)16-10(2)17(22-11(16)3)18(24)12(4)30-19(25)14-9-13(23(27)28)7-8-15(14)21-5/h7-9,12,21-22H,6H2,1-5H3/t12-/m0/s1