(4-bromanyl-5,5,8,8-tetramethyl-3-oxidanyl-6,7-dihydronaphthalen-2-yl)carbamoyl benzoate

Systemtic Name: (4-bromanyl-5,5,8,8-tetramethyl-3-oxidanyl-6,7-dihydronaphthalen-2-yl)carbamoyl benzoate Openeye Name: (8-bromo-7-hydroxy-1,1,4,4-tetramethyl-tetralin-6-yl)carbamoyl benzoate CAS Name: benzoic acid [[(4-bromo-3-hydroxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)amino]-oxomethyl] ester IUPAC Name: (4-bromo-3-hydroxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbamoyl benzoate Traditional Name: benzoic acid (8-bromo-7-hydroxy-1,1,4,4-tetramethyl-tetralin-6-yl)carbamoyl ester Formula: C22H24BrNO4 MolecularWeight: 446.33426

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C(C(=C(C=C21)NC(=O)OC(=O)C3=CC=CC=C3)O)Br)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C(C(=C(C=C21)NC(=O)OC(=O)C3=CC=CC=C3)O)Br)(C)C)C

InChI

InChI=1S/C22H24BrNO4/c1-21(2)10-11-22(3,4)16-14(21)12-15(18(25)17(16)23)24-20(27)28-19(26)13-8-6-5-7-9-13/h5-9,12,25H,10-11H2,1-4H3,(H,24,27)