ethyl 2-methyl-1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 2-methyl-1-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 2-methyl-1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCN3C(=NC=C3[N+](=O)[O-])C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCN3C(=NC=C3[N+](=O)[O-])C)C

InChI

InChI=1S/C20H22N4O4/c1-4-28-20(25)17-12-18(16-8-6-5-7-9-16)22(14(17)2)10-11-23-15(3)21-13-19(23)24(26)27/h5-9,12-13H,4,10-11H2,1-3H3