prop-2-ynyl 1-(5-chloranyl-2-nitro-phenyl)sulfonylpyrrole-2-carboxylate

Systemtic Name: prop-2-ynyl 1-(5-chloranyl-2-nitro-phenyl)sulfonylpyrrole-2-carboxylate Openeye Name: prop-2-ynyl 1-(5-chloro-2-nitro-phenyl)sulfonylpyrrole-2-carboxylate CAS Name: 1-(5-chloro-2-nitrophenyl)sulfonyl-2-pyrrolecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 1-(5-chloro-2-nitrophenyl)sulfonylpyrrole-2-carboxylate Traditional Name: 1-(5-chloro-2-nitro-phenyl)sulfonylpyrrole-2-carboxylic acid propargyl ester Formula: C14H9ClN2O6S MolecularWeight: 368.74906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9ClN2O6S/c1-2-8-23-14(18)12-4-3-7-16(12)24(21,22)13-9-10(15)5-6-11(13)17(19)20/h1,3-7,9H,8H2