ethyl 2-methyl-1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-5-(4-nitrophenyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-5-(4-nitrophenyl)pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-5-(4-nitrophenyl)pyrrole-3-carboxylate CAS Name: 2-methyl-1-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl]-5-(4-nitrophenyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]-5-(4-nitrophenyl)pyrrole-3-carboxylate Traditional Name: 2-methyl-1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-5-(4-nitrophenyl)pyrrole-3-carboxylic acid ethyl ester Formula: C20H21N5O6 MolecularWeight: 427.41064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N5O6/c1-4-31-20(26)17-11-18(15-5-7-16(8-6-15)24(27)28)22(13(17)2)9-10-23-14(3)21-12-19(23)25(29)30/h5-8,11-12H,4,9-10H2,1-3H3