propyl 5-[(2-chloranyl-5-nitro-phenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: propyl 5-[(2-chloranyl-5-nitro-phenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: propyl 5-[(2-chloro-5-nitro-phenyl)sulfonylamino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[(2-chloro-5-nitrophenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylic acid propyl ester IUPAC Name: propyl 5-[(2-chloro-5-nitrophenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(2-chloro-5-nitro-phenyl)sulfonylamino]-2-methyl-benzofuran-3-carboxylic acid propyl ester Formula: C19H17ClN2O7S MolecularWeight: 452.86548

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C19H17ClN2O7S/c1-3-8-28-19(23)18-11(2)29-16-7-4-12(9-14(16)18)21-30(26,27)17-10-13(22(24)25)5-6-15(17)20/h4-7,9-10,21H,3,8H2,1-2H3