ethyl 2,5-dimethyl-4-[2-[(3-nitrophenyl)amino]ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-[(3-nitrophenyl)amino]ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-(3-nitroanilino)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[2-(3-nitroanilino)-1-oxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-(3-nitroanilino)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-4-[2-(3-nitroanilino)acetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)CNC2=CC(=CC=C2)[N+](=O)[O-])C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)CNC2=CC(=CC=C2)[N+](=O)[O-])C)C

InChI

InChI=1S/C17H19N3O5/c1-4-25-17(22)16-11(3)19-10(2)15(16)14(21)9-18-12-6-5-7-13(8-12)20(23)24/h5-8,18-19H,4,9H2,1-3H3