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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCCCNC2=C(C=C(C=C2)Br)C(=O)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCCCNC2=C(C=C(C=C2)Br)C(=O)OC)C

InChI

InChI=1S/C19H22BrNO3/c1-13-6-4-7-18(14(13)2)24-11-5-10-21-17-9-8-15(20)12-16(17)19(22)23-3/h4,6-9,12,21H,5,10-11H2,1-3H3