[4-[2-oxidanylidene-3-(4-sulfooxyphenyl)-1H-indol-3-yl]phenyl] ethanoate

Systemtic Name: [4-[2-oxidanylidene-3-(4-sulfooxyphenyl)-1H-indol-3-yl]phenyl] ethanoate Openeye Name: [4-[2-oxo-3-(4-sulfooxyphenyl)indolin-3-yl]phenyl] acetate CAS Name: acetic acid [4-[2-oxo-3-(4-sulfooxyphenyl)-1H-indol-3-yl]phenyl] ester IUPAC Name: [4-[2-oxo-3-(4-sulfooxyphenyl)-1H-indol-3-yl]phenyl] acetate Traditional Name: acetic acid [4-[2-keto-3-(4-sulfoxyphenyl)indolin-3-yl]phenyl] ester Formula: C22H17NO7S MolecularWeight: 439.43788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2(C3=CC=CC=C3NC2=O)C4=CC=C(C=C4)OS(=O)(=O)O

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2(C3=CC=CC=C3NC2=O)C4=CC=C(C=C4)OS(=O)(=O)O

InChI

InChI=1S/C22H17NO7S/c1-14(24)29-17-10-6-15(7-11-17)22(19-4-2-3-5-20(19)23-21(22)25)16-8-12-18(13-9-16)30-31(26,27)28/h2-13H,1H3,(H,23,25)(H,26,27,28)