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

Systemtic Name: methyl 2-[4-(4-chloranylphenoxy)butylamino]-5-methyl-benzoate Openeye Name: methyl 2-[4-(4-chlorophenoxy)butylamino]-5-methyl-benzoate CAS Name: 2-[4-(4-chlorophenoxy)butylamino]-5-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[4-(4-chlorophenoxy)butylamino]-5-methylbenzoate Traditional Name: 2-[4-(4-chlorophenoxy)butylamino]-5-methyl-benzoic acid methyl ester Formula: C19H22ClNO3 MolecularWeight: 347.83588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22ClNO3/c1-14-5-10-18(17(13-14)19(22)23-2)21-11-3-4-12-24-16-8-6-15(20)7-9-16/h5-10,13,21H,3-4,11-12H2,1-2H3