[1-(4-chlorophenyl)-3-(dimethylamino)propyl] 4-bromanyl-2-methyl-benzoate

Systemtic Name: [1-(4-chlorophenyl)-3-(dimethylamino)propyl] 4-bromanyl-2-methyl-benzoate Openeye Name: [1-(4-chlorophenyl)-3-(dimethylamino)propyl] 4-bromo-2-methyl-benzoate CAS Name: 4-bromo-2-methylbenzoic acid [1-(4-chlorophenyl)-3-(dimethylamino)propyl] ester IUPAC Name: [1-(4-chlorophenyl)-3-(dimethylamino)propyl] 4-bromo-2-methylbenzoate Traditional Name: 4-bromo-2-methyl-benzoic acid [1-(4-chlorophenyl)-3-(dimethylamino)propyl] ester Formula: C19H21BrClNO2 MolecularWeight: 410.73254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrClNO2/c1-13-12-15(20)6-9-17(13)19(23)24-18(10-11-22(2)3)14-4-7-16(21)8-5-14/h4-9,12,18H,10-11H2,1-3H3