[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: [2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 5-bromanyl-2-chloranyl-benzoate Openeye Name: [2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl] 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid [2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl] ester IUPAC Name: [2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl] 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid [2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl] ester Formula: C21H19BrClNO3 MolecularWeight: 448.73746

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC(=O)COC(=O)C3=C(C=CC(=C3)Br)Cl)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=CC(=O)COC(=O)C3=C(C=CC(=C3)Br)Cl)C)C

InChI

InChI=1S/C21H19BrClNO3/c1-21(2)16-6-4-5-7-18(16)24(3)19(21)11-14(25)12-27-20(26)15-10-13(22)8-9-17(15)23/h4-11H,12H2,1-3H3