propan-2-yl 1-(5-chloranyl-2-nitro-phenyl)sulfonyl-4-(hydroxymethyl)pyrrole-2-carboxylate

Systemtic Name: propan-2-yl 1-(5-chloranyl-2-nitro-phenyl)sulfonyl-4-(hydroxymethyl)pyrrole-2-carboxylate Openeye Name: isopropyl 1-(5-chloro-2-nitro-phenyl)sulfonyl-4-(hydroxymethyl)pyrrole-2-carboxylate CAS Name: 1-(5-chloro-2-nitrophenyl)sulfonyl-4-(hydroxymethyl)-2-pyrrolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-(5-chloro-2-nitrophenyl)sulfonyl-4-(hydroxymethyl)pyrrole-2-carboxylate Traditional Name: 1-(5-chloro-2-nitro-phenyl)sulfonyl-4-methylol-pyrrole-2-carboxylic acid isopropyl ester Formula: C15H15ClN2O7S MolecularWeight: 402.8068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC(=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])CO

Isomeric SMILES

CC(C)OC(=O)C1=CC(=CN1S(=O)(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])CO

InChI

InChI=1S/C15H15ClN2O7S/c1-9(2)25-15(20)13-5-10(8-19)7-17(13)26(23,24)14-6-11(16)3-4-12(14)18(21)22/h3-7,9,19H,8H2,1-2H3