methyl 3-bromanyl-2-[2-(3,5-dimethylphenoxy)ethylamino]-5-methyl-benzoate

Systemtic Name: methyl 3-bromanyl-2-[2-(3,5-dimethylphenoxy)ethylamino]-5-methyl-benzoate Openeye Name: methyl 3-bromo-2-[2-(3,5-dimethylphenoxy)ethylamino]-5-methyl-benzoate CAS Name: 3-bromo-2-[2-(3,5-dimethylphenoxy)ethylamino]-5-methylbenzoic acid methyl ester IUPAC Name: methyl 3-bromo-2-[2-(3,5-dimethylphenoxy)ethylamino]-5-methylbenzoate Traditional Name: 3-bromo-2-[2-(3,5-dimethylphenoxy)ethylamino]-5-methyl-benzoic acid methyl ester Formula: C19H22BrNO3 MolecularWeight: 392.28688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCNC2=C(C=C(C=C2C(=O)OC)C)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCNC2=C(C=C(C=C2C(=O)OC)C)Br)C

InChI

InChI=1S/C19H22BrNO3/c1-12-7-13(2)9-15(8-12)24-6-5-21-18-16(19(22)23-4)10-14(3)11-17(18)20/h7-11,21H,5-6H2,1-4H3