2-[4-[(6-bromanyl-2-oxidanyl-naphthalen-1-yl)methyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-[(6-bromanyl-2-oxidanyl-naphthalen-1-yl)methyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[4-[(6-bromo-2-hydroxy-1-naphthyl)methyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[4-[(6-bromo-2-hydroxy-1-naphthalenyl)methyl]-1-piperazinyl]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[4-[(6-bromo-2-hydroxynaphthalen-1-yl)methyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[4-[(6-bromo-2-hydroxy-1-naphthyl)methyl]piperazino]-N-(2,6-dimethylphenyl)acetamide Formula: C25H28BrN3O2 MolecularWeight: 482.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC3=C(C=CC4=C3C=CC(=C4)Br)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC3=C(C=CC4=C3C=CC(=C4)Br)O

InChI

InChI=1S/C25H28BrN3O2/c1-17-4-3-5-18(2)25(17)27-24(31)16-29-12-10-28(11-13-29)15-22-21-8-7-20(26)14-19(21)6-9-23(22)30/h3-9,14,30H,10-13,15-16H2,1-2H3,(H,27,31)