[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] 3-bromanyl-5-methoxy-4-propoxy-benzoate

Systemtic Name: [2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] 3-bromanyl-5-methoxy-4-propoxy-benzoate Openeye Name: (2-indolin-1-yl-2-oxo-ethyl) 3-bromo-5-methoxy-4-propoxy-benzoate CAS Name: 3-bromo-5-methoxy-4-propoxybenzoic acid [2-(2,3-dihydroindol-1-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydroindol-1-yl)-2-oxoethyl] 3-bromo-5-methoxy-4-propoxybenzoate Traditional Name: 3-bromo-5-methoxy-4-propoxy-benzoic acid (2-indolin-1-yl-2-keto-ethyl) ester Formula: C21H22BrNO5 MolecularWeight: 448.30708

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)N2CCC3=CC=CC=C32)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)N2CCC3=CC=CC=C32)OC

InChI

InChI=1S/C21H22BrNO5/c1-3-10-27-20-16(22)11-15(12-18(20)26-2)21(25)28-13-19(24)23-9-8-14-6-4-5-7-17(14)23/h4-7,11-12H,3,8-10,13H2,1-2H3