(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (3-bromanyl-4-ethoxy-5-methoxy-phenyl)-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methanone Openeye Name: (3-bromo-4-ethoxy-5-methoxy-phenyl)-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methanone CAS Name: (3-bromo-4-ethoxy-5-methoxyphenyl)-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (3-bromo-4-ethoxy-5-methoxyphenyl)-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methanone Traditional Name: (3-bromo-4-ethoxy-5-methoxy-phenyl)-[4-(4-chlorobenzyl)piperazino]methanone Formula: C21H24BrClN2O3 MolecularWeight: 467.78386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C21H24BrClN2O3/c1-3-28-20-18(22)12-16(13-19(20)27-2)21(26)25-10-8-24(9-11-25)14-15-4-6-17(23)7-5-15/h4-7,12-13H,3,8-11,14H2,1-2H3