methyl 2-[3-(4-bromanylphenoxy)propylamino]-3-methyl-benzoate

Systemtic Name: methyl 2-[3-(4-bromanylphenoxy)propylamino]-3-methyl-benzoate Openeye Name: methyl 2-[3-(4-bromophenoxy)propylamino]-3-methyl-benzoate CAS Name: 2-[3-(4-bromophenoxy)propylamino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[3-(4-bromophenoxy)propylamino]-3-methylbenzoate Traditional Name: 2-[3-(4-bromophenoxy)propylamino]-3-methyl-benzoic acid methyl ester Formula: C18H20BrNO3 MolecularWeight: 378.2603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NCCCOC2=CC=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1NCCCOC2=CC=C(C=C2)Br)C(=O)OC

InChI

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