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

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

Isomeric SMILES

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

InChI

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