ethyl 2,5-dimethyl-1-[2-[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-2-oxidanylidene-ethyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-1-[2-[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-2-oxidanylidene-ethyl]pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-1-[2-[1-methyl-2-(3-nitroanilino)-2-oxo-ethoxy]-2-oxo-ethyl]pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-[2-[1-(3-nitroanilino)-1-oxopropan-2-yl]oxy-2-oxoethyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-1-[2-[1-(3-nitroanilino)-1-oxopropan-2-yl]oxy-2-oxoethyl]pyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-[2-keto-1-methyl-2-(3-nitroanilino)ethoxy]ethyl]-2,5-dimethyl-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(N(C(=C1)C)CC(=O)OC(C)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)OC(C)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C20H23N3O7/c1-5-29-20(26)17-9-12(2)22(13(17)3)11-18(24)30-14(4)19(25)21-15-7-6-8-16(10-15)23(27)28/h6-10,14H,5,11H2,1-4H3,(H,21,25)