ethyl 4-[(2-bromanyl-4-methyl-phenyl)amino]-2-methyl-2-oxidanyl-4-phenyl-butanoate

Systemtic Name: ethyl 4-[(2-bromanyl-4-methyl-phenyl)amino]-2-methyl-2-oxidanyl-4-phenyl-butanoate Openeye Name: ethyl 4-(2-bromo-4-methyl-anilino)-2-hydroxy-2-methyl-4-phenyl-butanoate CAS Name: 4-(2-bromo-4-methylanilino)-2-hydroxy-2-methyl-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 4-(2-bromo-4-methylanilino)-2-hydroxy-2-methyl-4-phenylbutanoate Traditional Name: 4-(2-bromo-4-methyl-anilino)-2-hydroxy-2-methyl-4-phenyl-butyric acid ethyl ester Formula: C20H24BrNO3 MolecularWeight: 406.31346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CC(C1=CC=CC=C1)NC2=C(C=C(C=C2)C)Br)O

Isomeric SMILES

CCOC(=O)C(C)(CC(C1=CC=CC=C1)NC2=C(C=C(C=C2)C)Br)O

InChI

InChI=1S/C20H24BrNO3/c1-4-25-19(23)20(3,24)13-18(15-8-6-5-7-9-15)22-17-11-10-14(2)12-16(17)21/h5-12,18,22,24H,4,13H2,1-3H3