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

Systemtic Name: methyl 5-bromanyl-2-[3-(2-methylphenoxy)propylamino]benzoate Openeye Name: methyl 5-bromo-2-[3-(2-methylphenoxy)propylamino]benzoate CAS Name: 5-bromo-2-[3-(2-methylphenoxy)propylamino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[3-(2-methylphenoxy)propylamino]benzoate Traditional Name: 5-bromo-2-[3-(2-methylphenoxy)propylamino]benzoic acid methyl ester Formula: C18H20BrNO3 MolecularWeight: 378.2603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCNC2=C(C=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1OCCCNC2=C(C=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C18H20BrNO3/c1-13-6-3-4-7-17(13)23-11-5-10-20-16-9-8-14(19)12-15(16)18(21)22-2/h3-4,6-9,12,20H,5,10-11H2,1-2H3