ethyl 1-(5-chloranyl-2-nitro-phenyl)sulfonyl-4-(chloromethyl)pyrrole-2-carboxylate

Systemtic Name: ethyl 1-(5-chloranyl-2-nitro-phenyl)sulfonyl-4-(chloromethyl)pyrrole-2-carboxylate Openeye Name: ethyl 4-(chloromethyl)-1-(5-chloro-2-nitro-phenyl)sulfonyl-pyrrole-2-carboxylate CAS Name: 4-(chloromethyl)-1-(5-chloro-2-nitrophenyl)sulfonyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(chloromethyl)-1-(5-chloro-2-nitrophenyl)sulfonylpyrrole-2-carboxylate Traditional Name: 4-(chloromethyl)-1-(5-chloro-2-nitro-phenyl)sulfonyl-pyrrole-2-carboxylic acid ethyl ester Formula: C14H12Cl2N2O6S MolecularWeight: 407.22588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])CCl

Isomeric SMILES

CCOC(=O)C1=CC(=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])CCl

InChI

InChI=1S/C14H12Cl2N2O6S/c1-2-24-14(19)12-5-9(7-15)8-17(12)25(22,23)13-6-10(16)3-4-11(13)18(20)21/h3-6,8H,2,7H2,1H3