5-bromanyl-3-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-prop-2-ynyl-indol-2-one

Systemtic Name: 5-bromanyl-3-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-prop-2-ynyl-indol-2-one Openeye Name: 5-bromo-3-[2-(4-ethoxyphenyl)-2-oxo-ethyl]-3-hydroxy-1-prop-2-ynyl-indolin-2-one CAS Name: 5-bromo-3-[2-(4-ethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-prop-2-ynyl-2-indolone IUPAC Name: 5-bromo-3-[2-(4-ethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-prop-2-ynylindol-2-one Traditional Name: 5-bromo-3-hydroxy-3-(2-keto-2-p-phenetyl-ethyl)-1-propargyl-oxindole Formula: C21H18BrNO4 MolecularWeight: 428.27592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CC#C)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CC#C)O

InChI

InChI=1S/C21H18BrNO4/c1-3-11-23-18-10-7-15(22)12-17(18)21(26,20(23)25)13-19(24)14-5-8-16(9-6-14)27-4-2/h1,5-10,12,26H,4,11,13H2,2H3