methyl 3-bromanyl-2-[4-(4-chloranylphenoxy)butylamino]-5-methyl-benzoate

Systemtic Name: methyl 3-bromanyl-2-[4-(4-chloranylphenoxy)butylamino]-5-methyl-benzoate Openeye Name: methyl 3-bromo-2-[4-(4-chlorophenoxy)butylamino]-5-methyl-benzoate CAS Name: 3-bromo-2-[4-(4-chlorophenoxy)butylamino]-5-methylbenzoic acid methyl ester IUPAC Name: methyl 3-bromo-2-[4-(4-chlorophenoxy)butylamino]-5-methylbenzoate Traditional Name: 3-bromo-2-[4-(4-chlorophenoxy)butylamino]-5-methyl-benzoic acid methyl ester Formula: C19H21BrClNO3 MolecularWeight: 426.73194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)OC)NCCCCOC2=CC=C(C=C2)Cl)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)OC)NCCCCOC2=CC=C(C=C2)Cl)Br

InChI

InChI=1S/C19H21BrClNO3/c1-13-11-16(19(23)24-2)18(17(20)12-13)22-9-3-4-10-25-15-7-5-14(21)6-8-15/h5-8,11-12,22H,3-4,9-10H2,1-2H3