3-bromanyl-2-[2-(4-tert-butylphenoxy)ethylamino]-5-methyl-benzoic acid

Systemtic Name: 3-bromanyl-2-[2-(4-tert-butylphenoxy)ethylamino]-5-methyl-benzoic acid Openeye Name: 3-bromo-2-[2-(4-tert-butylphenoxy)ethylamino]-5-methyl-benzoic acid CAS Name: 3-bromo-2-[2-(4-tert-butylphenoxy)ethylamino]-5-methylbenzoic acid IUPAC Name: 3-bromo-2-[2-(4-tert-butylphenoxy)ethylamino]-5-methylbenzoic acid Traditional Name: 3-bromo-2-[2-(4-tert-butylphenoxy)ethylamino]-5-methyl-benzoic acid Formula: C20H24BrNO3 MolecularWeight: 406.31346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)O)NCCOC2=CC=C(C=C2)C(C)(C)C)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)O)NCCOC2=CC=C(C=C2)C(C)(C)C)Br

InChI

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