[1-(3-bromophenyl)carbonyl-2,2,4-trimethyl-quinolin-6-yl] 3-bromanylbenzoate

Systemtic Name: [1-(3-bromophenyl)carbonyl-2,2,4-trimethyl-quinolin-6-yl] 3-bromanylbenzoate Openeye Name: [1-(3-bromobenzoyl)-2,2,4-trimethyl-6-quinolyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [1-[(3-bromophenyl)-oxomethyl]-2,2,4-trimethyl-6-quinolinyl] ester IUPAC Name: [1-(3-bromobenzoyl)-2,2,4-trimethylquinolin-6-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [1-(3-bromobenzoyl)-2,2,4-trimethyl-6-quinolyl] ester Formula: C26H21Br2NO3 MolecularWeight: 555.25784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=C1C=C(C=C2)OC(=O)C3=CC(=CC=C3)Br)C(=O)C4=CC(=CC=C4)Br)(C)C

Isomeric SMILES

CC1=CC(N(C2=C1C=C(C=C2)OC(=O)C3=CC(=CC=C3)Br)C(=O)C4=CC(=CC=C4)Br)(C)C

InChI

InChI=1S/C26H21Br2NO3/c1-16-15-26(2,3)29(24(30)17-6-4-8-19(27)12-17)23-11-10-21(14-22(16)23)32-25(31)18-7-5-9-20(28)13-18/h4-15H,1-3H3