3-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-4,6-bis(chloranyl)-3-oxidanyl-1H-indol-2-one; ethanol

Systemtic Name: 3-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-4,6-bis(chloranyl)-3-oxidanyl-1H-indol-2-one; ethanol Openeye Name: 3-[2-(1-adamantyl)-2-oxo-ethyl]-4,6-dichloro-3-hydroxy-indolin-2-one; ethanol CAS Name: 3-[2-(1-adamantyl)-2-oxoethyl]-4,6-dichloro-3-hydroxy-1H-indol-2-one; ethanol IUPAC Name: 3-[2-(1-adamantyl)-2-oxoethyl]-4,6-dichloro-3-hydroxy-1H-indol-2-one; ethanol Traditional Name: 3-[2-(1-adamantyl)-2-keto-ethyl]-4,6-dichloro-3-hydroxy-oxindole; ethanol Formula: C24H33Cl2NO5 MolecularWeight: 486.42852

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Descriptors Computed from Structure

Canonical SMILES:

CCO.CCO.C1C2CC3CC1CC(C2)(C3)C(=O)CC4(C5=C(C=C(C=C5NC4=O)Cl)Cl)O

Isomeric SMILES

CCO.CCO.C1C2CC3CC1CC(C2)(C3)C(=O)CC4(C5=C(C=C(C=C5NC4=O)Cl)Cl)O

InChI

InChI=1S/C20H21Cl2NO3.2C2H6O/c21-13-4-14(22)17-15(5-13)23-18(25)20(17,26)9-16(24)19-6-10-1-11(7-19)3-12(2-10)8-19;2*1-2-3/h4-5,10-12,26H,1-3,6-9H2,(H,23,25);2*3H,2H2,1H3