5-bromanyl-3-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-prop-2-enyl-indol-2-one

Systemtic Name: 5-bromanyl-3-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-prop-2-enyl-indol-2-one Openeye Name: 1-allyl-5-bromo-3-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]-3-hydroxy-indolin-2-one CAS Name: 5-bromo-3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-prop-2-enyl-2-indolone IUPAC Name: 5-bromo-3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-prop-2-enylindol-2-one Traditional Name: 1-allyl-5-bromo-3-[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]-3-hydroxy-oxindole Formula: C21H20BrNO5 MolecularWeight: 446.2912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CC=C)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CC=C)O)OC

InChI

InChI=1S/C21H20BrNO5/c1-4-9-23-16-7-6-14(22)11-15(16)21(26,20(23)25)12-17(24)13-5-8-18(27-2)19(10-13)28-3/h4-8,10-11,26H,1,9,12H2,2-3H3