ethyl 2-[4-(2,3-dihydroindol-1-ylcarbonyl)-2-nitro-phenyl]sulfonylethanoate

Systemtic Name: ethyl 2-[4-(2,3-dihydroindol-1-ylcarbonyl)-2-nitro-phenyl]sulfonylethanoate Openeye Name: ethyl 2-[4-(indoline-1-carbonyl)-2-nitro-phenyl]sulfonylacetate CAS Name: 2-[4-[2,3-dihydroindol-1-yl(oxo)methyl]-2-nitrophenyl]sulfonylacetic acid ethyl ester IUPAC Name: ethyl 2-[4-(2,3-dihydroindole-1-carbonyl)-2-nitrophenyl]sulfonylacetate Traditional Name: 2-[4-(indoline-1-carbonyl)-2-nitro-phenyl]sulfonylacetic acid ethyl ester Formula: C19H18N2O7S MolecularWeight: 418.42042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)C1=C(C=C(C=C1)C(=O)N2CCC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CS(=O)(=O)C1=C(C=C(C=C1)C(=O)N2CCC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O7S/c1-2-28-18(22)12-29(26,27)17-8-7-14(11-16(17)21(24)25)19(23)20-10-9-13-5-3-4-6-15(13)20/h3-8,11H,2,9-10,12H2,1H3