N-(4-bromanyl-2-methyl-phenyl)-2-[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[4-[(4-ethoxyphenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(4-ethoxybenzyl)piperazino]acetamide Formula: C22H28BrN3O2 MolecularWeight: 446.38062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)Br)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C22H28BrN3O2/c1-3-28-20-7-4-18(5-8-20)15-25-10-12-26(13-11-25)16-22(27)24-21-9-6-19(23)14-17(21)2/h4-9,14H,3,10-13,15-16H2,1-2H3,(H,24,27)