2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(3-chloranyl-4-methoxy-phenyl)ethanamide

Systemtic Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(3-chloranyl-4-methoxy-phenyl)ethanamide Openeye Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(3-chloro-4-methoxy-phenyl)acetamide CAS Name: 2-[4-[(3-bromophenyl)methyl]-1-piperazinyl]-N-(3-chloro-4-methoxyphenyl)acetamide IUPAC Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(3-chloro-4-methoxyphenyl)acetamide Traditional Name: 2-[4-(3-bromobenzyl)piperazino]-N-(3-chloro-4-methoxy-phenyl)acetamide Formula: C20H23BrClN3O2 MolecularWeight: 452.77252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)Br)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)Br)Cl

InChI

InChI=1S/C20H23BrClN3O2/c1-27-19-6-5-17(12-18(19)22)23-20(26)14-25-9-7-24(8-10-25)13-15-3-2-4-16(21)11-15/h2-6,11-12H,7-10,13-14H2,1H3,(H,23,26)